Vitas-M small molecule compound
methyl 4-[(12aS)-2-(1,3-benzodioxol-5-ylmethyl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Catalog ID
STL537119
SMILES COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
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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 C30H25N3O6 MW 523.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O6/c1-37-30(36)19-9-7-18(8-10-19)28-27-21(20-4-2-3-5-22(20)31-27)13-23-29(35)32(15-26(34)33(23)28)14-17-6-11-24-25(12-17)39-16-38-24/h2-12,23,28,31H,13-16H2,1H3/t23-,28?/m0/s1InChIKey
CJCICZCUARNRHC-UHFKCPIBSA-NSynonyms
956812-20-716401026
956812207
COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccc2c(c1)OCO2
InChI=1SC30H25N3O6c13730(36)199718(81019)282721(20423522(20)3127)132329(35)32(1526(34)33(23)28)14176112425(1217)39163824h212232831H1316H21H3t2328?m0s1
methyl4((12aS)2(13benzodioxol5ylmethyl)14dioxo1234671212aoctahydropyrazino(1216)pyrido(34b)indol6yl)benzoate
methyl4((12aS)2(benzo(d)(13)dioxol5ylmethyl)14dioxo1234671212aoctahydropyrazino(1216)pyrido(34b)indol6yl)benzoate
methyl4((8~(S))6(13benzodioxol5ylmethyl)47dioxo3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraen2yl)benzoate
MFCD05672426
ZINC000002112451
ZINC000002112453
Check stock
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