Vitas-M small molecule compound
(12bS)-7-(3-ethoxy-4-propoxyphenyl)-2-(furan-2-ylmethyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529933
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccco1
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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 C31H33N3O5 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O5/c1-4-14-39-25-13-12-20(16-26(25)37-5-2)23-18-34-27(35)19-33(17-21-9-8-15-38-21)30(36)31(34,3)29-28(23)22-10-6-7-11-24(22)32-29/h6-13,15-16,23,32H,4-5,14,17-19H2,1-3H3/t23?,31-/m0/s1InChIKey
QVOHNPFCPCCNKH-HPTWYVLESA-NSynonyms
956971-17-8(12bS)7(3ethoxy4propoxyphenyl)2(furan2ylmethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)2(furan2ylmethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)4(furan2ylmethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402580
956971178
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccco1
InChI=1SC31H33N3O5c14143925131220(1626(25)3752)23183427(35)1933(172198153821)30(36)31(343)2928(23)2210671124(22)3229h61315162332H45141719H213H3t23?31m0s1
MFCD06493947
ZINC000008788882
ZINC000012877621
Check stock
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Check stock on Vitas-MAvailable files
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