Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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Thermo Scientific Chemicals Anhydrotetracycline hydrochloride, 'can be used as a secondary standard'

CAS: 13803-65-1 Molecular Formula: C22H23ClN2O6 Molecular Weight (g/mol): 446.88 MDL Number: MFCD00151453 InChI Key: FFZXKJVSZDKEMY-XGRJIHFXNA-N Synonym: anhydrotetracycline hydrochloride,unii-ovg14h105r,anhydrotetracycline hcl,c22h22n2o7.hcl,2-naphthacenecarboxamide, 4-dimethylamino-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-, monohydrochloride, 4s-4alpha,4aalpha,12aalpha,4-dimethylamino-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-2-naphthacenecarboxamide monohydrochloride, 4s-4alpha,4aalpha,12aalpha,anhydrotetracycline hydrochloride, vetranal tm , analytical standard,anhydrotetracycline hydrochloride, certified reference material, tracecert r,anhydrotetracycline hydrochloride, european pharmacopoeia ep reference standard,anhydrotetracycline hydrochloride, united states pharmacopeia usp reference standard PubChem CID: 54710409 IUPAC Name: (4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride SMILES: [H+].[Cl-].CN(C)C1C2CC3=C(C(O)=C4C=CC=CC4=C3C)C(=O)C2(O)C(=O)\C(=C(\N)O)C1=O

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PubChem CID	54710409
CAS	13803-65-1
Molecular Weight (g/mol)	446.88
MDL Number	MFCD00151453
SMILES	[H+].[Cl-].CN(C)C1C2CC3=C(C(O)=C4C=CC=CC4=C3C)C(=O)C2(O)C(=O)\C(=C(\N)O)C1=O
Synonym	anhydrotetracycline hydrochloride,unii-ovg14h105r,anhydrotetracycline hcl,c22h22n2o7.hcl,2-naphthacenecarboxamide, 4-dimethylamino-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-, monohydrochloride, 4s-4alpha,4aalpha,12aalpha,4-dimethylamino-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-2-naphthacenecarboxamide monohydrochloride, 4s-4alpha,4aalpha,12aalpha,anhydrotetracycline hydrochloride, vetranal tm , analytical standard,anhydrotetracycline hydrochloride, certified reference material, tracecert r,anhydrotetracycline hydrochloride, european pharmacopoeia ep reference standard,anhydrotetracycline hydrochloride, united states pharmacopeia usp reference standard
IUPAC Name	(4S,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride
InChI Key	FFZXKJVSZDKEMY-XGRJIHFXNA-N
Molecular Formula	C22H23ClN2O6

Thermo Scientific Chemicals Daptomycin

CAS: 103060-53-3 Molecular Formula: C₇₂H₁₀₁N₁₇O₂₆ Molecular Weight (g/mol): 1620.67 InChI Key: DOAKLVKFURWEDJ-AVSAZHKKSA-N Synonym: daptomycin PubChem CID: 133640189 SMILES: CCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC3C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C

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PubChem CID	133640189
CAS	103060-53-3
Molecular Weight (g/mol)	1620.67
SMILES	CCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC3C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C
Synonym	daptomycin
InChI Key	DOAKLVKFURWEDJ-AVSAZHKKSA-N
Molecular Formula	C₇₂H₁₀₁N₁₇O₂₆

Thermo Scientific Chemicals Doxycycline hyclate, 98%

CAS: 24390-14-5 Molecular Formula: ₀·5 C₂H₆O Molecular Weight (g/mol): 512.94 InChI Key: ISZOFWGVNMFENH-YDLUHMIOSA-N Synonym: doryx,doxycycline hyclate,doxycycline, hydrochloride, hemiethanolate, hemihydrate; PubChem CID: 131676157 IUPAC Name: (4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;ethanol;dihydrate;hydrochloride SMILES: CCO.CCO.CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O.O.Cl

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PubChem CID	131676157
CAS	24390-14-5
Molecular Weight (g/mol)	512.94
SMILES	CCO.CCO.CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O.O.Cl
Synonym	doryx,doxycycline hyclate,doxycycline, hydrochloride, hemiethanolate, hemihydrate;
IUPAC Name	(4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;ethanol;dihydrate;hydrochloride
InChI Key	ISZOFWGVNMFENH-YDLUHMIOSA-N
Molecular Formula	₀·5 C₂H₆O

Thermo Scientific Chemicals 4-Epitetracycline hydrochloride, can be used as a secondary standard

CAS: 23313-80-6 Molecular Formula: C₂₂H₂₄N₂O₈·HCl Molecular Weight (g/mol): 480.89 MDL Number: MFCD00865028 InChI Key: YCIHPQHVWDULOY-DXDJYCPMSA-N Synonym: 4-epitetracycline hydrochloride,epitetracycline hydrochloride,4-epi-tetracycline hydrochloride,quatrimycin hydrochloride,epitetracycline hcl,unii-i7c3edl2yg,i7c3edl2yg,epitetracycline hydrochloride usp,4r,4as,5as,6s,12as-4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrochloride PubChem CID: 54686189 IUPAC Name: (4R,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride SMILES: CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl

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PubChem CID	54686189
CAS	23313-80-6
Molecular Weight (g/mol)	480.89
MDL Number	MFCD00865028
SMILES	CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl
Synonym	4-epitetracycline hydrochloride,epitetracycline hydrochloride,4-epi-tetracycline hydrochloride,quatrimycin hydrochloride,epitetracycline hcl,unii-i7c3edl2yg,i7c3edl2yg,epitetracycline hydrochloride usp,4r,4as,5as,6s,12as-4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrochloride
IUPAC Name	(4R,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride
InChI Key	YCIHPQHVWDULOY-DXDJYCPMSA-N
Molecular Formula	C₂₂H₂₄N₂O₈·HCl

Thermo Scientific Chemicals beta-Apo-oxytetracycline, 'can be used as secondary standard'

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Brefeldin A, 98%, Thermo Scientific Chemicals

CAS: 20350-15-6 Molecular Formula: C16H24O4 Molecular Weight (g/mol): 280.36 MDL Number: MFCD00083258,MFCD12913297 InChI Key: KQNZDYYTLMIZCT-PNFJWZTBSA-N Synonym: brefeldin a,cyanein,decumbin,bfa PubChem CID: 133640201 SMILES: C[C@H]1CCC\C=C\[C@@H]2C[C@H](O)C[C@H]2[C@@H](O)\C=C\C(=O)O1

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PubChem CID	133640201
CAS	20350-15-6
Molecular Weight (g/mol)	280.36
MDL Number	MFCD00083258,MFCD12913297
SMILES	C[C@H]1CCC\C=C\[C@@H]2C[C@H](O)C[C@H]2[C@@H](O)\C=C\C(=O)O1
Synonym	brefeldin a,cyanein,decumbin,bfa
InChI Key	KQNZDYYTLMIZCT-PNFJWZTBSA-N
Molecular Formula	C16H24O4

Thermo Scientific Chemicals Puromycin dihydrochloride hydrate, 99%

CAS: 58-58-2 Molecular Formula: C22H31Cl2N7O5 Molecular Weight (g/mol): 544.43 MDL Number: MFCD00150080 InChI Key: MKSVFGKWZLUTTO-MLYJQVMKNA-N Synonym: puromycin dihydrochloride PubChem CID: 131632508 IUPAC Name: (2S)-2-amino-N-[(2S,3S,4S,5R)-5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-(4-methoxyphenyl)propanamide;dihydrochloride SMILES: Cl.Cl.COC1=CC=C(C[C@H](N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)N2C=NC3=C(N=CN=C23)N(C)C)C=C1

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PubChem CID	131632508
CAS	58-58-2
Molecular Weight (g/mol)	544.43
MDL Number	MFCD00150080
SMILES	Cl.Cl.COC1=CC=C(C[C@H](N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)N2C=NC3=C(N=CN=C23)N(C)C)C=C1
Synonym	puromycin dihydrochloride
IUPAC Name	(2S)-2-amino-N-[(2S,3S,4S,5R)-5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-(4-methoxyphenyl)propanamide;dihydrochloride
InChI Key	MKSVFGKWZLUTTO-MLYJQVMKNA-N
Molecular Formula	C22H31Cl2N7O5

Thermo Scientific Chemicals 4-Epianhydrotetracycline hydrochloride, can be used as a secondary standard

CAS: 4465-65-0 Molecular Formula: C₂₂H₂₂N₂O₇·HCl Molecular Weight (g/mol): 462.89 MDL Number: MFCD00151455 InChI Key: SPFAOPCHYIJPHJ-MOMXNFOMSA-N Synonym: 4-epianhydrotetracycline hydrochloride,unii-06y7hm8dba,06y7hm8dba,4-epi-anhydrotetracycline hydrochloride,4-epi-ahydrochloride,4-epianhydrotetracycline hcl,epianhydrotetracycline hydrochloride,4-epianhydrotetracycline hydrochloride, vetranal tm , analytical standard,4-epianhydrotetracycline hydrochloride, european pharmacopoeia ep reference standard,4-epianhydrotetracycline hydrochloride, united states pharmacopeia usp reference standard PubChem CID: 54682545 IUPAC Name: (4R,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride SMILES: CC1=C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C.Cl

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PubChem CID	54682545
CAS	4465-65-0
Molecular Weight (g/mol)	462.89
MDL Number	MFCD00151455
SMILES	CC1=C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C.Cl
Synonym	4-epianhydrotetracycline hydrochloride,unii-06y7hm8dba,06y7hm8dba,4-epi-anhydrotetracycline hydrochloride,4-epi-ahydrochloride,4-epianhydrotetracycline hcl,epianhydrotetracycline hydrochloride,4-epianhydrotetracycline hydrochloride, vetranal tm , analytical standard,4-epianhydrotetracycline hydrochloride, european pharmacopoeia ep reference standard,4-epianhydrotetracycline hydrochloride, united states pharmacopeia usp reference standard
IUPAC Name	(4R,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride
InChI Key	SPFAOPCHYIJPHJ-MOMXNFOMSA-N
Molecular Formula	C₂₂H₂₂N₂O₇·HCl

7-Anca, Thermo Scientific Chemicals

CAS: 36923-17-8 Molecular Formula: C7H8N2O3S Molecular Weight (g/mol): 200.21 InChI Key: RJFPBECTFIUTHB-UHFFFAOYNA-N IUPAC Name: 7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid SMILES: NC1C2SCC=C(N2C1=O)C(O)=O

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CAS	36923-17-8
Molecular Weight (g/mol)	200.21
SMILES	NC1C2SCC=C(N2C1=O)C(O)=O
IUPAC Name	7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChI Key	RJFPBECTFIUTHB-UHFFFAOYNA-N
Molecular Formula	C7H8N2O3S

Thermo Scientific Chemicals Nafcillin sodium salt

CAS: 985-16-0 Molecular Formula: C21H21N2NaO5S Molecular Weight (g/mol): 436.46 MDL Number: MFCD00056863 InChI Key: AYAPZOUDXCDGIF-FRFVDRIFSA-M Synonym: 4-thia-1-azabicyclo 3.2.0 heptane-2-carboxylicacid, 6-2-ethoxy-1-naphthalenyl carbonyl amino-3,3-dimethyl-7-oxo-, sodiumsalt 1:1 , 2s,5r,6r PubChem CID: 131675018 IUPAC Name: (2S,5R,6R)-6-[(2-ethoxynaphthalene-1-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;molecular hydrogen;sodium SMILES: [Na+].CCOC1=CC=C2C=CC=CC2=C1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C([O-])=O

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PubChem CID	131675018
CAS	985-16-0
Molecular Weight (g/mol)	436.46
MDL Number	MFCD00056863
SMILES	[Na+].CCOC1=CC=C2C=CC=CC2=C1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C([O-])=O
Synonym	4-thia-1-azabicyclo 3.2.0 heptane-2-carboxylicacid, 6-2-ethoxy-1-naphthalenyl carbonyl amino-3,3-dimethyl-7-oxo-, sodiumsalt 1:1 , 2s,5r,6r
IUPAC Name	(2S,5R,6R)-6-[(2-ethoxynaphthalene-1-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;molecular hydrogen;sodium
InChI Key	AYAPZOUDXCDGIF-FRFVDRIFSA-M
Molecular Formula	C21H21N2NaO5S

Thermo Scientific Chemicals 4-Epichlortetracycline hydrochloride, can be used as secondary standard

CAS: 101342-45-4 Molecular Formula: C₂₂H₂₃ClN₂O₈·ClH Molecular Weight (g/mol): 515.34 MDL Number: MFCD09842537 InChI Key: QYAPHLRPFNSDNH-PNEIEYGESA-N Synonym: epichlortetracycline hydrochloride PubChem CID: 92043146 IUPAC Name: (4R,4aS,5aS,6R,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride SMILES: CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O.Cl

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PubChem CID	92043146
CAS	101342-45-4
Molecular Weight (g/mol)	515.34
MDL Number	MFCD09842537
SMILES	CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O.Cl
Synonym	epichlortetracycline hydrochloride
IUPAC Name	(4R,4aS,5aS,6R,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride
InChI Key	QYAPHLRPFNSDNH-PNEIEYGESA-N
Molecular Formula	C₂₂H₂₃ClN₂O₈·ClH

Thermo Scientific Chemicals Ceftiofur hydrochloride

CAS: 103980-44-5 Molecular Formula: C19H18ClN5O7S3 Molecular Weight (g/mol): 560.01 InChI Key: KEQFDTJEEQKVLM-JUODUXDSSA-N IUPAC Name: (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(furan-2-carbonylsulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrochloride SMILES: Cl.CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(CSC(=O)C3=CC=CO3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1

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CAS	103980-44-5
Molecular Weight (g/mol)	560.01
SMILES	Cl.CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(CSC(=O)C3=CC=CO3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1
IUPAC Name	(6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(furan-2-carbonylsulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrochloride
InChI Key	KEQFDTJEEQKVLM-JUODUXDSSA-N
Molecular Formula	C19H18ClN5O7S3

Dimidium Bromide-Disulfine, Extra Pure, Blue Indicator Stock Solution, SLR, Fisher Chemical™

Dimidium Bromide-Disulfine, Extra Pure, Blue Indicator Stock Solution, SLR, Fisher Chemical, Quantity: 100mL, Packaging: Amber glass bottle, Boiling Point: 100 deg.C, Melting Point: 0 deg.C, MDL Number: 146696, Physical Form: Liquid

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Thermo Scientific Chemicals D-(+)-Xylose, 98+%

CAS: 58-86-6 Molecular Formula: C₅H₁₀O₅ MDL Number: MFCD00151475

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CAS	58-86-6
MDL Number	MFCD00151475
Molecular Formula	C₅H₁₀O₅

Silicone oil, for oil baths, usable range from -40 to +200°C, Thermo Scientific Chemicals

CAS: 63148-62-9 Molecular Formula: (C2H6OSi)n Molecular Weight (g/mol): NaN MDL Number: MFCD00132673 IUPAC Name: Polydimethylsiloxane SMILES: C[Si](C)(-*)O-*

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CAS	63148-62-9
Molecular Weight (g/mol)	NaN
MDL Number	MFCD00132673
SMILES	C[Si](C)(-)O-
IUPAC Name	Polydimethylsiloxane
Molecular Formula	(C2H6OSi)n

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