Vitas-M small molecule compound
6-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5,9-trimethyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL461164
SMILES O=C(N1CCC2(C(C1)CCCC2)O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)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 C31H33NO5 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO5/c1-18-23-15-25-27(21-9-5-4-6-10-21)20(3)36-29(25)19(2)28(23)37-30(34)24(18)16-26(33)32-14-13-31(35)12-8-7-11-22(31)17-32/h4-6,9-10,15,22,35H,7-8,11-14,16-17H2,1-3H3InChIKey
FPQJLBVHMGBSFN-UHFFFAOYSA-NSynonyms
6(2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethyl)259trimethyl3phenylfuro(32g)chromen7one
6(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)259trimethyl3phenyl7Hfuro(32g)chromen7one
CC1=C(C(=O)OC2=C1C=C3C(=C(OC3=C2C)C)C4=CC=CC=C4)CC(=O)N5CCC6(CCCCC6C5)O
InChI=1SC31H33NO5c11823152527(2195461021)20(3)3629(25)19(2)28(23)3730(34)24(18)1626(33)32141331(35)12871122(31)1732h46910152235H7811141617H213H3
MFCD10040828
ZINC000002111940
ZINC000011867084
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