Vitas-M small molecule compound
(12bS)-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL532423
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCOC(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 C32H41N3O5 MW 547.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H41N3O5/c1-6-16-40-26-14-13-22(18-27(26)38-7-2)24-19-35-28(36)20-34(15-10-17-39-21(3)4)31(37)32(35,5)30-29(24)23-11-8-9-12-25(23)33-30/h8-9,11-14,18,21,24,33H,6-7,10,15-17,19-20H2,1-5H3/t24?,32-/m0/s1InChIKey
KMPKMEMQMCEUJK-TWAVRPEISA-NSynonyms
956815-89-7(12bS)7(3ethoxy4propoxyphenyl)12bmethyl2(3(propan2yloxy)propyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)2(3isopropoxypropyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)2methyl4(3propan2yloxypropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402457
956815897
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCOC(C)C
InChI=1SC32H41N3O5c16164026141322(1827(26)3872)24193528(36)2034(1510173921(3)4)31(37)32(355)3029(24)2311891225(23)3330h89111418212433H671015171920H215H3t24?32m0s1
MFCD06493690
ZINC000070692262
ZINC000070692263
Check stock
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Check stock on Vitas-MAvailable files
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