Vitas-M small molecule compound
3-benzyl-8-(3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylmethyl)-7-hydroxy-4-methyl-2H-chromen-2-one
Catalog ID
STL511543
SMILES Oc1ccc2c(c1CN1CCCC3=CC4CC(C13)CN1CCCCC41)oc(=O)c(c2C)Cc1ccccc1
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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 C33H38N2O3 MW 510.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38N2O3/c1-21-26-12-13-30(36)28(32(26)38-33(37)27(21)16-22-8-3-2-4-9-22)20-35-15-7-10-23-17-24-18-25(31(23)35)19-34-14-6-5-11-29(24)34/h2-4,8-9,12-13,17,24-25,29,31,36H,5-7,10-11,14-16,18-20H2,1H3InChIKey
WFVQIZJBQCDMOZ-UHFFFAOYSA-NSynonyms
135638008
3benzyl8(((6R6aR13R13aS)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)methyl)7hydroxy4methyl2Hchromen2one
3benzyl8(315diazatetracyclo(7710^(27)0^(1015))heptadec7en3ylmethyl)7hydroxy4methylchromen2one
3benzyl8(34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)ylmethyl)7hydroxy4methyl2Hchromen2one
InChI=1SC33H38N2O3c12126121330(36)28(32(26)3833(37)27(21)16228324922)2035157102317241825(31(23)35)193414651129(24)34h24891213172425293136H57101114161820H21H3
MFCD31751689
Oc1ccc2c(c1CN1CCCC3=C(C@H)4C(C@H)((C@H)13)CN1CCCC(C@H)41)oc(=O)c(c2C)Cc1ccccc1
ZINC000524732081
ZINC001614474480
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