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]-3-(1H-indol-3-yl)propan-1-one
Catalog ID
STL548828
SMILES O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)CCc1c[nH]c2c1cccc2
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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 C26H33N3O MW 403.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O/c30-25(11-10-19-16-27-23-8-2-1-7-22(19)23)29-13-5-6-18-14-20-15-21(26(18)29)17-28-12-4-3-9-24(20)28/h1-2,7-8,14,16,20-21,24,26-27H,3-6,9-13,15,17H2/t20-,21+,24+,26+/m0/s1InChIKey
ZXJAOWMVDHPZJN-OFPDSVIMSA-NSynonyms
1((6R6aR13R13aS)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)3(1Hindol3yl)propan1one
1((6R6aR13S13aS)34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl)3(1Hindol3yl)propan1one
InChI=1SC26H33N3Oc3025(111019162723821722(19)23)2913561814201521(26(18)29)17281243924(20)28h127814162021242627H369131517H2t2021+24+26+m0s1
O=C(N1CCCC2=C(C@H)3C(C@H)((C@H)12)CN1CCCC(C@H)31)CCc1c(nH)c2c1cccc2
ZINC000253415182
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