Vitas-M small molecule compound
(12aS)-2-cyclopentyl-6-[3-methoxy-4-(propan-2-yloxy)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL548173
SMILES COc1cc(ccc1OC(C)C)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCC1
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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 C29H33N3O4 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O4/c1-17(2)36-24-13-12-18(14-25(24)35-3)28-27-21(20-10-6-7-11-22(20)30-27)15-23-29(34)31(16-26(33)32(23)28)19-8-4-5-9-19/h6-7,10-14,17,19,23,28,30H,4-5,8-9,15-16H2,1-3H3/t23-,28?/m0/s1InChIKey
JZZMVWFHXBJSRA-UHFKCPIBSA-NSynonyms
957000-94-1(12aS)2cyclopentyl6(3methoxy4(propan2yloxy)phenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2cyclopentyl6(4isopropoxy3methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6cyclopentyl2(3methoxy4propan2yloxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400290
957000941
COc1cc(ccc1OC(C)C)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)C1CCCC1
InChI=1SC29H33N3O4c117(2)3624131218(1425(24)353)282721(2010671122(20)3027)152329(34)31(1626(33)32(23)28)19845919h6710141719232830H45891516H213H3t2328?m0s1
MFCD05671171
ZINC000002109271
ZINC000002109274
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