Vitas-M small molecule compound
(12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537643
SMILES O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2[C@H]1Cc1c(C2C)[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 C23H21N3O4 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4/c1-13-22-16(15-4-2-3-5-17(15)24-22)9-18-23(28)25(11-21(27)26(13)18)10-14-6-7-19-20(8-14)30-12-29-19/h2-8,13,18,24H,9-12H2,1H3/t13?,18-/m0/s1InChIKey
MUODXDWXMZYTEY-UWBLVGDVSA-NSynonyms
957043-42-4(12aS)2(13benzodioxol5ylmethyl)6methyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(benzo(d)(13)dioxol5ylmethyl)6methyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(13benzodioxol5ylmethyl)2methyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399601
957043424
InChI=1SC23H21N3O4c1132216(15423517(15)2422)91823(28)25(1121(27)26(13)18)1014671920(814)30122919h28131824H912H21H3t13?18m0s1
MFCD04144593
O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2(C@H)1Cc1c(C2C)(nH)c2c1cccc2
ZINC000002102007
ZINC000002102009
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