Vitas-M small molecule compound

(3aS,4R,9bR)-4-(1,2-dihydroacenaphthylen-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid

Catalog ID
STL280625
SMILES OC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccc2c3c1cccc3CC2

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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 C25H21NO2 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO2/c27-25(28)16-10-12-22-21(13-16)17-4-2-6-19(17)24(26-22)20-11-9-15-8-7-14-3-1-5-18(20)23(14)15/h1-5,9-13,17,19,24,26H,6-8H2,(H,27,28)/t17-,19+,24-/m1/s1
InChIKey
NSNMLIQCAUGIDN-YIGJPRQDSA-N
Synonyms

(3aS4R9bR)4(12dihydroacenaphthylen5yl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylicacid
C1CC2=CC=CC3=C(C=CC1=C23)C4C5CC=CC5C6=C(N4)C=CC(=C6)C(=O)O
InChI=1SC25H21NO2c2725(28)1610122221(1316)1742619(17)24(2622)2011915871431518(20)23(14)15h1591317192426H68H2(H2728)t1719+24m1s1
MFCD24850133
OC(=O)c1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1ccc2c3c1cccc3CC2
ZINC000004362917
ZINC4362917

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Available files

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