Vitas-M small molecule compound

(12bS)-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2-(tetrahydrofuran-2-ylmethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL532857
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CC1CCCO1

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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 C30H35N3O5 MW 517.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O5/c1-18(2)38-24-12-11-19(14-25(24)36-4)22-16-33-26(34)17-32(15-20-8-7-13-37-20)29(35)30(33,3)28-27(22)21-9-5-6-10-23(21)31-28/h5-6,9-12,14,18,20,22,31H,7-8,13,15-17H2,1-4H3/t20?,22?,30-/m0/s1
InChIKey
NVMUCBTVZRMYLY-DHEXMDGUSA-N
Synonyms
956980-23-7
(12bS)7(3methoxy4(propan2yloxy)phenyl)12bmethyl2(tetrahydrofuran2ylmethyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4isopropoxy3methoxyphenyl)12bmethyl2((tetrahydrofuran2yl)methyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propan2yloxyphenyl)2methyl4(oxolan2ylmethyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403228
956980237
InChI=1SC30H35N3O5c118(2)3824121119(1425(24)364)22163326(34)1732(152087133720)29(35)30(333)2827(22)219561023(21)3128h569121418202231H78131517H214H3t20?22?30m0s1
MFCD06495362
ZINC000008789569
ZINC000012879540

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Available files

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