Vitas-M small molecule compound

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

Catalog ID
STL529162
SMILES CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)C1CCCC1

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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 C30H35N3O4 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O4/c1-4-15-37-24-14-13-19(16-25(24)36-3)22-17-33-26(34)18-32(20-9-5-6-10-20)29(35)30(33,2)28-27(22)21-11-7-8-12-23(21)31-28/h7-8,11-14,16,20,22,31H,4-6,9-10,15,17-18H2,1-3H3/t22?,30-/m0/s1
InChIKey
QRAGGZVOVDIVCX-YBJSGSKQSA-N
Synonyms
956951-76-1
(12bS)2cyclopentyl7(3methoxy4propoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2cyclopentyl7(3methoxy4propoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4cyclopentyl9(3methoxy4propoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402039
956951761
CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C1CCCC1
InChI=1SC30H35N3O4c14153724141319(1625(24)363)22173326(34)1832(209561020)29(35)30(332)2827(22)2111781223(21)3128h78111416202231H46910151718H213H3t22?30m0s1
MFCD06492763
ZINC000012873480
ZINC000012873488

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Available files

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