Vitas-M small molecule compound
methyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK050923
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
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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 C32H31NO5 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31NO5/c1-20-29(32(35)37-3)30(31-25(33-20)16-24(17-26(31)34)22-12-8-5-9-13-22)23-14-15-27(28(18-23)36-2)38-19-21-10-6-4-7-11-21/h4-15,18,24,30,33H,16-17,19H2,1-3H3InChIKey
OMZADOWJJZXNFY-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)c1ccccc1
InChI=1SC32H31NO5c12029(32(35)373)30(3125(3320)1624(1726(31)34)22128591322)23141527(28(1823)362)381921106471121h41518243033H161719H213H3
methyl4(3methoxy4phenylmethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
methyl4(4(benzyloxy)3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
MFCD00771251
STK050923
ZINC000000651802
ZINC000002925492
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