Vitas-M small molecule compound
(12bS)-7-(2,3-dimethoxyphenyl)-12b-methyl-2-(2-phenylethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529906
SMILES COc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1ccccc1
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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 C31H31N3O4 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O4/c1-31-29-27(22-12-7-8-14-24(22)32-29)23(21-13-9-15-25(37-2)28(21)38-3)18-34(31)26(35)19-33(30(31)36)17-16-20-10-5-4-6-11-20/h4-15,23,32H,16-19H2,1-3H3/t23?,31-/m0/s1InChIKey
YNKZFCURGLCOSR-HPTWYVLESA-NSynonyms
956917-91-2(12bS)7(23dimethoxyphenyl)12bmethyl2(2phenylethyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(23dimethoxyphenyl)12bmethyl2phenethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(23dimethoxyphenyl)2methyl4(2phenylethyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403344
956917912
COc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1ccccc1
InChI=1SC31H31N3O4c1312927(2212781424(22)3229)23(211391525(372)28(21)383)1834(31)26(35)1933(30(31)36)171620105461120h4152332H1619H213H3t23?31m0s1
MFCD06495624
ZINC000008789673
ZINC000008789675
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