Vitas-M small molecule compound
(12bS)-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2-(2-methylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL531561
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CC(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 C30H37N3O4 MW 503.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N3O4/c1-6-14-37-24-13-12-20(15-25(24)36-7-2)22-17-33-26(34)18-32(16-19(3)4)29(35)30(33,5)28-27(22)21-10-8-9-11-23(21)31-28/h8-13,15,19,22,31H,6-7,14,16-18H2,1-5H3/t22?,30-/m0/s1InChIKey
HDSSISBBZVACTH-YBJSGSKQSA-NSynonyms
956812-82-1(12bS)7(3ethoxy4propoxyphenyl)12bmethyl2(2methylpropyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)2isobutyl12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)2methyl4(2methylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402166
956812821
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CC(C)C
InChI=1SC30H37N3O4c16143724131220(1525(24)3672)22173326(34)1832(1619(3)4)29(35)30(335)2827(22)2110891123(21)3128h81315192231H67141618H215H3t22?30m0s1
MFCD06493062
ZINC000012874661
ZINC000012874666
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