Vitas-M small molecule compound
2,2,3-trimethyl-3-[(4-sulfophenyl)carbamoyl]cyclopentanecarboxylic acid
Catalog ID
STK329436
SMILES OC(=O)C1CCC(C1(C)C)(C)C(=O)Nc1ccc(cc1)S(=O)(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H21NO6S MW 355.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO6S/c1-15(2)12(13(18)19)8-9-16(15,3)14(20)17-10-4-6-11(7-5-10)24(21,22)23/h4-7,12H,8-9H2,1-3H3,(H,17,20)(H,18,19)(H,21,22,23)InChIKey
ONQUDWNJNBNMFH-UHFFFAOYSA-NSynonyms
223trimethyl3((4sulfophenyl)carbamoyl)cyclopentane1carboxylicacid
223trimethyl3((4sulfophenyl)carbamoyl)cyclopentanecarboxylicacid
CC1(C(CCC1(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)O)C(=O)O)C
InChI=1SC16H21NO6Sc115(2)12(13(18)19)8916(153)14(20)17104611(7510)24(2122)23h4712H89H213H3(H1720)(H1819)(H212223)
MFCD09961902
ZINC000012346099
ZINC000012346116
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