Vitas-M small molecule compound
(12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537161
SMILES COc1cc(CCN2CC(=O)N3[C@H](C2=O)Cc2c(C3c3ccccc3OC)[nH]c3c2cccc3)ccc1OC
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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 C31H31N3O5 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O5/c1-37-25-11-7-5-9-21(25)30-29-22(20-8-4-6-10-23(20)32-29)17-24-31(36)33(18-28(35)34(24)30)15-14-19-12-13-26(38-2)27(16-19)39-3/h4-13,16,24,30,32H,14-15,17-18H2,1-3H3/t24-,30?/m0/s1InChIKey
OTPITEBFUSPEPV-YJJLJQPASA-NSynonyms
956940-23-1(12aS)2(2(34dimethoxyphenyl)ethyl)6(2methoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(34dimethoxyphenethyl)6(2methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(2(34dimethoxyphenyl)ethyl)2(2methoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401401
956940231
COc1cc(CCN2CC(=O)N3(C@H)(C2=O)Cc2c(C3c3ccccc3OC)(nH)c3c2cccc3)ccc1OC
InChI=1SC31H31N3O5c137251175921(25)302922(208461023(20)3229)172431(36)33(1828(35)34(24)30)151419121326(382)27(1619)393h41316243032H14151718H213H3t2430?m0s1
MFCD05674410
ZINC000002118849
ZINC000002118851
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