Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-(4-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537599
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)OC
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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 C30H29N3O4 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4/c1-3-37-26-11-7-5-9-22(26)29-28-23(21-8-4-6-10-24(21)31-28)16-25-30(35)32(18-27(34)33(25)29)17-19-12-14-20(36-2)15-13-19/h4-15,25,29,31H,3,16-18H2,1-2H3/t25-,29?/m0/s1InChIKey
BSCPJJFMYJQNSY-GMMLNUAGSA-NSynonyms
956976-82-2(12aS)6(2ethoxyphenyl)2(4methoxybenzyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(2ethoxyphenyl)2(4methoxybenzyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(2ethoxyphenyl)6((4methoxyphenyl)methyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400398
956976822
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccc(cc1)OC
InChI=1SC30H29N3O4c1337261175922(26)292823(218461024(21)3128)162530(35)32(1827(34)33(25)29)1719121420(362)151319h415252931H31618H212H3t2529?m0s1
MFCD05671348
ZINC000002109848
ZINC000002109849
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