Vitas-M small molecule compound
(12bS)-7-(3-methoxy-4-propoxyphenyl)-12b-methyl-2-(4-methylbenzyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL532307
SMILES CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccc(cc1)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 C33H35N3O4 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O4/c1-5-16-40-27-15-14-23(17-28(27)39-4)25-19-36-29(37)20-35(18-22-12-10-21(2)11-13-22)32(38)33(36,3)31-30(25)24-8-6-7-9-26(24)34-31/h6-15,17,25,34H,5,16,18-20H2,1-4H3/t25?,33-/m0/s1InChIKey
KRPZYESCDXUFEZ-ZEWJHAJUSA-NSynonyms
956812-89-8(12bS)7(3methoxy4propoxyphenyl)12bmethyl2(4methylbenzyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3methoxy4propoxyphenyl)12bmethyl2(4methylbenzyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propoxyphenyl)2methyl4((4methylphenyl)methyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402555
956812898
CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccc(cc1)C
InChI=1SC33H35N3O4c15164027151423(1728(27)394)25193629(37)2035(1822121021(2)111322)32(38)33(363)3130(25)24867926(24)3431h615172534H5161820H214H3t25?33m0s1
MFCD06493909
ZINC000070692322
ZINC000070692323
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.