Biochemicals

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Estrone 3-O-Sulfamate
- ≥97%
Cas Number: 148672-09-7

Formula: C₁₈H₂₃NO₄S Molecular Weight: 349.44

IUPAC Name: [(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfamate

SMILES: CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)N

InChIKey: RVKFQAJIXCZXQY-CBZIJGRNSA-N

InChI: InChI=1S/C18H23NO4S/c1-18-9-8-14-13-5-3-12(23-24(19,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16H,2,4,6-9H2,1H3,(H2,19,21,22)/t14-,15-,16show more

Synonyms: BDBM50134329 | 1,8-dihydroxy-anthraquinone | 17-Oxoestra-1,3,5(10)-triene-3-yl Sulfamate | DAC 893 | Estrone-3-O-sulf...
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Methyl 4-hydroxycinnamate
- ≥98%
Cas Number: 3943-97-3

Formula: C₁₀H₁₀O₃ Molecular Weight: 178.2

IUPAC Name: methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

SMILES: COC(=O)C=CC1=CC=C(C=C1)O

InChIKey: NITWSHWHQAQBAW-QPJJXVBHSA-N

InChI: InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3/b7-4+

Synonyms: Cinnamic acid, p-hydroxy-, methyl ester (8CI) | Methyl Trans-P-Coumaric Acid | AG-690/03019022 | CHEBI:86904 | Methyl...
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Cephalothin, Inhibitor of Organic anion transporter 3;Inhibitor of Organic anion transporter 4
- ≥98%
Cas Number: 153-61-7

Formula: C₁₆H₁₆N₂O₆S₂ Molecular Weight: 396.4

IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)O

InChIKey: XIURVHNZVLADCM-IUODEOHRSA-N

InChI: InChI=1S/C16H16N2O6S2/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23)/t12-,15-/show more

Synonyms: (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid ...
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Methyl 2,5-Dihydroxybenzoate
- ≥98%
Cas Number: 2150-46-1 EC Number: 218-427-8

Formula: C₈H₈O₄ Molecular Weight: 168.15

IUPAC Name: methyl 2,5-dihydroxybenzoate

SMILES: COC(=O)C1=C(C=CC(=C1)O)O

InChIKey: XGDPKUKRQHHZTH-UHFFFAOYSA-N

InChI: InChI=1S/C8H8O4/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4,9-10H,1H3

Synonyms: Benzoic acid, 2,5-dihydroxy-, methyl ester | Gentisic acid, methyl ester | MFCD00016464 | N-CARBOBENZYLOXY-D-PHENYLAL...
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Topiramate, Sodium channel alpha subunit blocker
- ≥98%
Cas Number: 97240-79-4 Compound CID: 5284627

Formula: C₁₂H₂₁NO₈S Molecular Weight: 339.36

IUPAC Name: [(1R,2S,6S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-6-yl]methyl sulfamate

SMILES: CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)C

InChIKey: KJADKKWYZYXHBB-XBWDGYHZSA-N

InChI: InChI=1S/C12H21NO8S/c1-10(2)18-7-5-16-12(6-17-22(13,14)15)9(8(7)19-10)20-11(3,4)21-12/h7-9H,5-6H2,1-4H3,(H2,13,14,15)/t7-,8-,9+,12+/m1/s1

Synonyms: McN 4853 | RWJ 17021 | [(1R,2S,6S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecan-6-yl]m...
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L-Histidine, Activator of carbonic anhydrase 1;Activator of carbonic anhydrase 14;Activator of carbonic anhydrase 5A;Activator of carbonic anhydrase 7
Cas Number: 71-00-1 EC Number: 200-745-3

Formula: C₆H₉N₃O₂ Molecular Weight: 155.15

IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid

SMILES: C1=C(NC=N1)CC(C(=O)O)N

InChIKey: HNDVDQJCIGZPNO-YFKPBYRVSA-N

InChI: InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1

Synonyms: His | NSC 137773 | [3H]histidine | [3H]-histidine | amino-4-imidazoleproprionic acid | BDBM181118 | L-Histidin | L-be...
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4-Methylumbelliferyl β-D-galactopyranoside
- ≥98%
Cas Number: 6160-78-7

Formula: C₁₆H₁₈O₈ Molecular Weight: 338.31

IUPAC Name: 4-methyl-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O

InChIKey: YUDPTGPSBJVHCN-DZQJYWQESA-N

InChI: InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13+,14+,15-,16-/m1/s1

Synonyms: 4-Methylumbelliferyl | HY-137845 | 4-Methylumbelliferyl b-D-galactoside | SMR000543676 | CHEBI:91116 | 4-methylumbel...
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4-Methylumbelliferyl β-D-glucopyranoside
- ≥99%
Cas Number: 18997-57-4 EC Number: 242-736-7

Formula: C₁₆H₁₈O₈ Molecular Weight: 338.31

IUPAC Name: 4-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O

InChIKey: YUDPTGPSBJVHCN-YMILTQATSA-N

InChI: InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1

Synonyms: A813381 | HY-123633 | YUDPTGPSBJVHCN-YMILTQATSA-N | 4-methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-glucopyranoside | BDBM...
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Cefotaxime acid
- ≥95%
Cas Number: 63527-52-6

Formula: C₁₆H₁₇N₅O₇S₂ Molecular Weight: 455.46

IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic ashow more

SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(=NOC)C3=CSC(=N3)N)SC1)C(=O)O

InChIKey: GPRBEKHLDVQUJE-QSWIMTSFSA-N

InChI: InChI=1S/C16H17N5O7S2/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,2show more

Synonyms: 4kot | BDBM50482777 | Cefotaximum | Diglycidylester kyseliny hexahydroftalove [Czech] | J01DA10 | C06885 | EN300-2170...
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Cefotaxime acid
- 10mM in DMSO
Cas Number: 63527-52-6

Formula: C₁₆H₁₇N₅O₇S₂ Molecular Weight: 455.46

IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic ashow more

SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(=NOC)C3=CSC(=N3)N)SC1)C(=O)O

InChIKey: GPRBEKHLDVQUJE-QSWIMTSFSA-N

InChI: InChI=1S/C16H17N5O7S2/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,2show more

Synonyms: cefotaxime|Cephotaxime|63527-52-6|Cefotaxima|Cefotaximum|Omnatax|Taxim|Cefotaxim Hikma|CHEBI:204928|UNII-N2GI8B1GK7|6...
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Cephalothin, Inhibitor of Organic anion transporter 3;Inhibitor of Organic anion transporter 4
- 10mM in DMSO
Cas Number: 153-61-7

Formula: C₁₆H₁₆N₂O₆S₂ Molecular Weight: 396.4

IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)O

InChIKey: XIURVHNZVLADCM-IUODEOHRSA-N

InChI: InChI=1S/C16H16N2O6S2/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23)/t12-,15-/show more

Synonyms: (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid ...
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Methyl 2,5-Dihydroxybenzoate
- 10mM in DMSO
Cas Number: 2150-46-1(DMSO)

Formula: C₈H₈O₄ Molecular Weight: 168.15
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