Vitas-M small molecule compound
(6R,13S)-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(5,6-dimethoxy-1H-indol-2-yl)methanone
Catalog ID
STL548119
SMILES COc1cc2[nH]c(cc2cc1OC)C(=O)N1CCCC2=C[C@@H]3C[C@H](C12)CN1CCCCC31
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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 C26H33N3O3 MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O3/c1-31-23-13-17-12-21(27-20(17)14-24(23)32-2)26(30)29-9-5-6-16-10-18-11-19(25(16)29)15-28-8-4-3-7-22(18)28/h10,12-14,18-19,22,25,27H,3-9,11,15H2,1-2H3/t18-,19+,22?,25?/m0/s1InChIKey
GOUTZQWACIUWLS-YTOMUFSBSA-NSynonyms
(56dimethoxy1Hindol2yl)((6R13R)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocin1yl)methanone
(6R13S)34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl(56dimethoxy1Hindol2yl)methanone
COc1cc2(nH)c(cc2cc1OC)C(=O)N1CCCC2=C(C@H)3C(C@H)(C12)CN1CCCCC31
InChI=1SC26H33N3O3c1312313171221(2720(17)1424(23)322)26(30)299561610181119(25(16)29)1528843722(18)28h1012141819222527H391115H212H3t1819+22?25?m0s1
ZINC000409413933
ZINC000409413941
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