Vitas-M small molecule compound
(12bS)-2-[2-(1H-indol-3-yl)ethyl]-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529465
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1c[nH]c2c1cccc2
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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 C35H36N4O4 MW 576.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N4O4/c1-21(2)43-29-14-13-22(17-30(29)42-4)26-19-39-31(40)20-38(16-15-23-18-36-27-11-7-5-9-24(23)27)34(41)35(39,3)33-32(26)25-10-6-8-12-28(25)37-33/h5-14,17-18,21,26,36-37H,15-16,19-20H2,1-4H3/t26?,35-/m0/s1InChIKey
KYAIXJLNAUMUEX-KYCPNWFMSA-NSynonyms
956960-67-1(12bS)2(2(1Hindol3yl)ethyl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(2(1Hindol3yl)ethyl)7(4isopropoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(2(1~(H)indol3yl)ethyl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403753
956960671
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1c(nH)c2c1cccc2
InChI=1SC35H36N4O4c121(2)4329141322(1730(29)424)26193931(40)2038(1615231836271175924(23)27)34(41)35(393)3332(26)2510681228(25)3733h514171821263637H15161920H214H3t26?35m0s1
MFCD06765178
ZINC000070699318
ZINC000070699321
Check stock
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Check stock on Vitas-MAvailable files
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