Vitas-M small molecule compound
(12aS)-6-(3-methoxyphenyl)-2-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536746
SMILES COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1
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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 C29H27N3O3 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3/c1-35-21-11-7-10-20(16-21)28-27-23(22-12-5-6-13-24(22)30-27)17-25-29(34)31(18-26(33)32(25)28)15-14-19-8-3-2-4-9-19/h2-13,16,25,28,30H,14-15,17-18H2,1H3/t25-,28?/m0/s1InChIKey
LGKMZSAZHZXZTD-ALLRNTDFSA-NSynonyms
956920-61-9(12aS)6(3methoxyphenyl)2(2phenylethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(3methoxyphenyl)2phenethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(3methoxyphenyl)6(2phenylethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400435
956920619
COc1cccc(c1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccccc1
InChI=1SC29H27N3O3c135211171020(1621)282723(2212561324(22)3027)172529(34)31(1826(33)32(25)28)1514198324919h21316252830H14151718H21H3t2528?m0s1
MFCD05671404
ZINC000002109963
ZINC000002109965
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