Vitas-M small molecule compound

(12bS)-7-(3-methoxy-4-propoxyphenyl)-12b-methyl-2-(3-phenylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL528998
SMILES CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCc1ccccc1

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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 C34H37N3O4 MW 551.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N3O4/c1-4-19-41-28-17-16-24(20-29(28)40-3)26-21-37-30(38)22-36(18-10-13-23-11-6-5-7-12-23)33(39)34(37,2)32-31(26)25-14-8-9-15-27(25)35-32/h5-9,11-12,14-17,20,26,35H,4,10,13,18-19,21-22H2,1-3H3/t26?,34-/m0/s1
InChIKey
CZRVAWDNBWUAQW-BFZOCEIISA-N
Synonyms
956919-46-3
(12bS)7(3methoxy4propoxyphenyl)12bmethyl2(3phenylpropyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3methoxy4propoxyphenyl)12bmethyl2(3phenylpropyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propoxyphenyl)2methyl4(3phenylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404316
956919463
CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCc1ccccc1
InChI=1SC34H37N3O4c14194128171624(2029(28)403)26213730(38)2236(18101323116571223)33(39)34(372)3231(26)2514891527(25)3532h5911121417202635H4101318192122H213H3t26?34m0s1
MFCD06766743
ZINC000070700357
ZINC000070700359

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Available files

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