Vitas-M small molecule compound
4-[(3aS,4R,9bR)-8-acetyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acid
Catalog ID
STL221961
SMILES CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccc(cc1)C(=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 C21H19NO3 MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO3/c1-12(23)15-9-10-19-18(11-15)16-3-2-4-17(16)20(22-19)13-5-7-14(8-6-13)21(24)25/h2-3,5-11,16-17,20,22H,4H2,1H3,(H,24,25)/t16-,17+,20+/m1/s1InChIKey
NXZMPSFMEMOYEX-UWVAXJGDSA-NSynonyms
4((3aS4R9bR)8acetyl3a459btetrahydro3Hcyclopenta(c)quinolin4yl)benzoicacid
CC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC=C(C=C4)C(=O)O
CC(=O)c1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1ccc(cc1)C(=O)O
InChI=1SC21H19NO3c112(23)159101918(1115)1632417(16)20(2219)135714(8613)21(24)25h2351116172022H4H21H3(H2425)t1617+20+m1s1
MFCD24857514
ZINC000004140545
ZINC4140545
Check stock
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