Vitas-M small molecule compound
1-[(6R,6aR,13S,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-2-(5-methoxy-1H-indol-1-yl)ethanone
Catalog ID
STL548691
SMILES COc1ccc2c(c1)ccn2CC(=O)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31
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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 C26H33N3O2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O2/c1-31-22-7-8-24-18(15-22)9-12-28(24)17-25(30)29-11-4-5-19-13-20-14-21(26(19)29)16-27-10-3-2-6-23(20)27/h7-9,12-13,15,20-21,23,26H,2-6,10-11,14,16-17H2,1H3/t20-,21+,23+,26+/m0/s1InChIKey
SFHCSZLHAMASRL-DCDYHQBJSA-NSynonyms
1((6R6aR13R13aS)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)2(5methoxy1Hindol1yl)ethanone
1((6R6aR13S13aS)34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl)2(5methoxy1Hindol1yl)ethanone
COc1ccc2c(c1)ccn2CC(=O)N1CCCC2=C(C@H)3C(C@H)((C@H)12)CN1CCCC(C@H)31
InChI=1SC26H33N3O2c13122782418(1522)91228(24)1725(30)2911451913201421(26(19)29)16271032623(20)27h7912131520212326H261011141617H21H3t2021+23+26+m0s1
ZINC000253412843
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