Vitas-M small molecule compound

(12bS)-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-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
STL529307
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=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 C33H35N3O4 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O4/c1-21(2)40-27-15-14-23(18-28(27)39-4)25-19-36-29(37)20-35(17-16-22-10-6-5-7-11-22)32(38)33(36,3)31-30(25)24-12-8-9-13-26(24)34-31/h5-15,18,21,25,34H,16-17,19-20H2,1-4H3/t25?,33-/m0/s1
InChIKey
KQWSTJADFNCGDH-ZEWJHAJUSA-N
Synonyms
956999-64-7
(12bS)7(3methoxy4(propan2yloxy)phenyl)12bmethyl2(2phenylethyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4isopropoxy3methoxyphenyl)12bmethyl2phenethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3methoxy4propan2yloxyphenyl)2methyl4(2phenylethyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16401993
956999647
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1ccccc1
InChI=1SC33H35N3O4c121(2)4027151423(1828(27)394)25193629(37)2035(171622106571122)32(38)33(363)3130(25)2412891326(24)3431h51518212534H16171920H214H3t25?33m0s1
MFCD06492658
ZINC000070692000
ZINC000070692001

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Available files

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