Vitas-M small molecule compound
1-[9-hydroxy-2-(propan-2-yl)-10-(2,3,4-trimethoxyphenyl)-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl]ethanone
Catalog ID
STL546088
SMILES COc1c(ccc(c1OC)OC)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)C(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 C27H29N3O5 MW 475.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O5/c1-14(2)29-12-17-22(16-10-11-21(33-4)26(35-6)25(16)34-5)24-19(13-30(15(3)31)27(24)32)28-18-8-7-9-20(29)23(17)18/h7-12,14,22,32H,13H2,1-6H3InChIKey
QAPJGIXRNRUPRW-UHFFFAOYSA-NSynonyms
1(9hydroxy2(propan2yl)10(234trimethoxyphenyl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC27H29N3O5c114(2)29121722(16101121(334)26(356)25(16)345)2419(1330(15(3)31)27(24)32)281887920(29)23(17)18h712142232H13H216H3
MFCD31756347
ZINC000409414166
ZINC000409414167
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