Vitas-M small molecule compound
2-phenoxyethyl 2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK378926
SMILES O=C(C1=C(C)NC2=C(C1c1coc3c(c1=O)cccc3)C(=O)CC(C2)(C)C)OCCOc1ccccc1
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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 C30H29NO6 MW 499.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO6/c1-18-25(29(34)36-14-13-35-19-9-5-4-6-10-19)26(27-22(31-18)15-30(2,3)16-23(27)32)21-17-37-24-12-8-7-11-20(24)28(21)33/h4-12,17,26,31H,13-16H2,1-3H3InChIKey
SWYKVESLABFPSL-UHFFFAOYSA-NSynonyms
2phenoxyethyl277trimethyl5oxo4(4oxo4Hchromen3yl)145678hexahydroquinoline3carboxylate
2phenoxyethyl277trimethyl5oxo4(4oxochromen3yl)1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=COC4=CC=CC=C4C3=O)C(=O)OCCOC5=CC=CC=C5
InChI=1SC30H29NO6c11825(29(34)361413351995461019)26(2722(3118)1530(23)1623(27)32)2117372412871120(24)28(21)33h412172631H1316H213H3
MFCD01825094
ZINC000002834463
ZINC000002834464
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