Vitas-M small molecule compound
(12aS)-6-(3,4-dimethoxyphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL538026
SMILES COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(C)C
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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-15(2)13-28-14-23(30)29-20(26(28)31)12-18-17-7-5-6-8-19(17)27-24(18)25(29)16-9-10-21(32-3)22(11-16)33-4/h5-11,15,20,25,27H,12-14H2,1-4H3/t20-,25?/m0/s1InChIKey
GELZNRNXZQLXCV-JINQPTGOSA-NSynonyms
956935-41-4(12aS)6(34dimethoxyphenyl)2(2methylpropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(34dimethoxyphenyl)2isobutyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(34dimethoxyphenyl)6(2methylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399954
956935414
COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CC(C)C
InChI=1SC26H29N3O4c115(2)13281423(30)2920(26(28)31)121817756819(17)2724(18)25(29)1691021(323)22(1116)334h51115202527H1214H214H3t2025?m0s1
MFCD04146681
ZINC000002107415
ZINC000002107416
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