Vitas-M small molecule compound
1-[(3-carboxy-2,2-dimethylcyclopropyl)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid
Catalog ID
STL249576
SMILES OC(=O)C1Cc2c(N1C(=O)C1C(C1(C)C)C(=O)O)cccc2
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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 C16H17NO5 MW 303.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5/c1-16(2)11(12(16)15(21)22)13(18)17-9-6-4-3-5-8(9)7-10(17)14(19)20/h3-6,10-12H,7H2,1-2H3,(H,19,20)(H,21,22)InChIKey
CASGVVWONVPEQW-UHFFFAOYSA-NSynonyms
(2S)1(3carboxy22dimethylcyclopropanecarbonyl)indoline2carboxylicacid
1((3carboxy22dimethylcyclopropyl)carbonyl)23dihydro1Hindole2carboxylicacid
1(3carboxy22dimethylcyclopropanecarbonyl)23dihydroindole2carboxylicacid
CC1(C(C1C(=O)O)C(=O)N2C(CC3=CC=CC=C32)C(=O)O)C
InChI=1SC16H17NO5c116(2)11(12(16)15(21)22)13(18)17964358(9)710(17)14(19)20h361012H7H212H3(H1920)(H2122)
MFCD24861574
OC(=O)(C@@H)1Cc2c(N1C(=O)C1C(C1(C)C)C(=O)O)cccc2
ZINC000072402075
ZINC000080336774
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