Vitas-M small molecule compound
cyclopentyl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363806
SMILES Cc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)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 C28H31NO5 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO5/c1-15-9-10-22-18(11-15)26(31)19(14-33-22)24-23(27(32)34-17-7-5-6-8-17)16(2)29-20-12-28(3,4)13-21(30)25(20)24/h9-11,14,17,24,29H,5-8,12-13H2,1-4H3InChIKey
FUCISFGNDJIQEK-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OC5CCCC5)C
cyclopentyl277trimethyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
cyclopentyl277trimethyl4(6methyl4oxochromen3yl)5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC28H31NO5c1159102218(1115)26(31)19(143322)2423(27(32)3417756817)16(2)29201228(34)1321(30)25(20)24h91114172429H581213H214H3
MFCD01824512
ZINC000000801156
ZINC000000801157
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