Vitas-M small molecule compound
propan-2-yl 4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372281
SMILES COc1cc(ccc1OCc1ccccc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC(C)C
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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 C30H35NO5 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO5/c1-18(2)36-29(33)26-19(3)31-22-15-30(4,5)16-23(32)28(22)27(26)21-12-13-24(25(14-21)34-6)35-17-20-10-8-7-9-11-20/h7-14,18,27,31H,15-17H2,1-6H3InChIKey
IAOGZPLCFXJUPB-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OC(C)C
InChI=1SC30H35NO5c118(2)3629(33)2619(3)31221530(45)1623(32)28(22)27(26)21121324(25(1421)346)351720108791120h714182731H1517H216H3
MFCD00753245
propan2yl4(3methoxy4phenylmethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
propan2yl4(4(benzyloxy)3methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000003094426
ZINC000019536286
Check stock
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Check stock on Vitas-MAvailable files
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