Vitas-M small molecule compound

(12aS)-2-(2,2-dimethoxyethyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL536751
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(OC)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 C26H29N3O5 MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O5/c1-4-34-21-12-8-6-10-17(21)25-24-18(16-9-5-7-11-19(16)27-24)13-20-26(31)28(14-22(30)29(20)25)15-23(32-2)33-3/h5-12,20,23,25,27H,4,13-15H2,1-3H3/t20-,25?/m0/s1
InChIKey
UBLUTAJDFBCDIL-JINQPTGOSA-N
Synonyms
956944-27-7
(12aS)2(22dimethoxyethyl)6(2ethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(22dimethoxyethyl)6(2ethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(22dimethoxyethyl)2(2ethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400655
956944277
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CC(OC)OC
InChI=1SC26H29N3O5c14342112861017(21)252418(169571119(16)2724)132026(31)28(1422(30)29(20)25)1523(322)333h51220232527H41315H213H3t2025?m0s1
MFCD05671776
ZINC000002111261
ZINC000002111263

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Available files

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