Vitas-M small molecule compound
cyclopentyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363172
SMILES COc1cc(ccc1OCc1ccccc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCC1
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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 C30H33NO5 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO5/c1-19-27(30(33)36-22-11-6-7-12-22)28(29-23(31-19)13-8-14-24(29)32)21-15-16-25(26(17-21)34-2)35-18-20-9-4-3-5-10-20/h3-5,9-10,15-17,22,28,31H,6-8,11-14,18H2,1-2H3InChIKey
YWHQCLFFALTHED-UHFFFAOYSA-NSynonyms
299453-12-6299453126
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OC5CCCC5
cyclopentyl4(3methoxy4phenylmethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
cyclopentyl4(4(benzyloxy)3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
InChI=1SC30H33NO5c11927(30(33)362211671222)28(2923(3119)1381424(29)32)21151625(26(1721)342)35182094351020h359101517222831H68111418H212H3
MFCD00717853
ZINC000000626480
ZINC000000626487
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