Vitas-M small molecule compound
(12aS)-6-(2,3-dimethoxyphenyl)-2-(4-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537212
SMILES COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2OC)OC)[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 C30H29N3O5 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O5/c1-36-19-13-11-18(12-14-19)16-32-17-26(34)33-24(30(32)35)15-22-20-7-4-5-9-23(20)31-27(22)28(33)21-8-6-10-25(37-2)29(21)38-3/h4-14,24,28,31H,15-17H2,1-3H3/t24-,28?/m0/s1InChIKey
MJEXMEBZQKEQNJ-ZZDYIDRTSA-NSynonyms
957044-44-9(12aS)6(23dimethoxyphenyl)2(4methoxybenzyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(23dimethoxyphenyl)2(4methoxybenzyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(23dimethoxyphenyl)6((4methoxyphenyl)methyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399558
957044449
COc1ccc(cc1)CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2OC)OC)(nH)c2c1cccc2
InChI=1SC30H29N3O5c13619131118(121419)16321726(34)3324(30(32)35)152220745923(20)3127(22)28(33)21861025(372)29(21)383h414242831H1517H213H3t2428?m0s1
MFCD04144349
ZINC000002156333
ZINC000002156335
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