Vitas-M small molecule compound
(12bS)-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2-(propan-2-yl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529066
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)C(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 C28H33N3O4 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O4/c1-16(2)30-15-24(32)31-14-20(18-11-12-22(35-17(3)4)23(13-18)34-6)25-19-9-7-8-10-21(19)29-26(25)28(31,5)27(30)33/h7-13,16-17,20,29H,14-15H2,1-6H3/t20?,28-/m0/s1InChIKey
HFYOKIUYDALFIO-GPIXMLASSA-NSynonyms
956953-59-6(12bS)7(3methoxy4(propan2yloxy)phenyl)12bmethyl2(propan2yl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4isopropoxy3methoxyphenyl)2isopropyl12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propan2yloxyphenyl)2methyl4propan2yl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402273
956953596
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C(C)C
InChI=1SC28H33N3O4c116(2)301524(32)311420(18111222(3517(3)4)23(1318)346)25199781021(19)2926(25)28(315)27(30)33h71316172029H1415H216H3t20?28m0s1
MFCD06493290
ZINC000012875683
ZINC000012875694
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