Vitas-M small molecule compound
3-[8-acetyl-9-hydroxy-2-(3-methylbutyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]-6-methoxy-4H-chromen-4-one
Catalog ID
STL551510
SMILES COc1ccc2c(c1)c(=O)c(co2)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)CCC(C)C)C(=O)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 C30H29N3O5 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O5/c1-16(2)10-11-32-13-20-26(21-15-38-25-9-8-18(37-4)12-19(25)29(21)35)28-23(14-33(17(3)34)30(28)36)31-22-6-5-7-24(32)27(20)22/h5-9,12-13,15-16,26,36H,10-11,14H2,1-4H3InChIKey
XGCVRJHUNXCJFX-UHFFFAOYSA-NSynonyms
3(8acetyl9hydroxy2(3methylbutyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)6methoxy4Hchromen4one
InChI=1SC30H29N3O5c116(2)101132132026(211538259818(374)1219(25)29(21)35)2823(1433(17(3)34)30(28)36)312265724(32)27(20)22h59121315162636H101114H214H3
MFCD31758179
ZINC000888090039
ZINC000888090040
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