Vitas-M small molecule compound
(12aS)-2-(3-butoxypropyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL541075
SMILES CCCCOCCCN1CC(=O)N2[C@H](C1=O)Cc1c(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 C22H29N3O3 MW 383.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O3/c1-3-4-11-28-12-7-10-24-14-20(26)25-15(2)21-17(13-19(25)22(24)27)16-8-5-6-9-18(16)23-21/h5-6,8-9,15,19,23H,3-4,7,10-14H2,1-2H3/t15?,19-/m0/s1InChIKey
CYRGZSURHJNQJD-FUBQLUNQSA-NSynonyms
956946-17-1(12aS)2(3butoxypropyl)6methyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(3butoxypropyl)6methyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(3butoxypropyl)2methyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399640
956946171
CCCCOCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2C)(nH)c2c1cccc2
InChI=1SC22H29N3O3c134112812710241420(26)2515(2)2117(1319(25)22(24)27)16856918(16)2321h5689151923H3471014H212H3t15?19m0s1
MFCD04144822
ZINC000004063280
ZINC000004063283
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