Vitas-M small molecule compound
(12bS)-7-(3-methoxy-4-propoxyphenyl)-12b-methyl-2-propyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529319
SMILES CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCC
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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 C28H33N3O4 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O4/c1-5-13-30-17-24(32)31-16-20(18-11-12-22(35-14-6-2)23(15-18)34-4)25-19-9-7-8-10-21(19)29-26(25)28(31,3)27(30)33/h7-12,15,20,29H,5-6,13-14,16-17H2,1-4H3/t20?,28-/m0/s1InChIKey
LDLLQQPQLQFWIF-GPIXMLASSA-NSynonyms
956973-60-7(12bS)7(3methoxy4propoxyphenyl)12bmethyl2propyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3methoxy4propoxyphenyl)12bmethyl2propyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propoxyphenyl)2methyl4propyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402855
956973607
CCCOc1ccc(cc1OC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCC
InChI=1SC28H33N3O4c1513301724(32)311620(18111222(351462)23(1518)344)25199781021(19)2926(25)28(313)27(30)33h712152029H5613141617H214H3t20?28m0s1
MFCD06494548
ZINC000008789165
ZINC000008789166
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