Vitas-M small molecule compound
5-{3-[(6R,13S)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-3-oxopropyl}-2-hydroxy-3-(2-phenylethyl)-3,5-dihydro-4H-imidazol-4-one
Catalog ID
STL549157
SMILES O=C(N1CCCC2=C[C@@H]3C[C@H](C12)CN1CCCCC31)CCC1N=C(N(C1=O)CCc1ccccc1)O
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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 C29H38N4O3 MW 490.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O3/c34-26(12-11-24-28(35)33(29(36)30-24)16-13-20-7-2-1-3-8-20)32-15-6-9-21-17-22-18-23(27(21)32)19-31-14-5-4-10-25(22)31/h1-3,7-8,17,22-25,27H,4-6,9-16,18-19H2,(H,30,36)/t22-,23+,24?,25?,27?/m0/s1InChIKey
HTNWKCNDUPIRQK-YZDDTYPASA-NSynonyms
5(3((6R13S)34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)yl)3oxopropyl)2hydroxy3(2phenylethyl)35dihydro4Himidazol4one
InChI=1SC29H38N4O3c3426(12112428(35)33(29(36)3024)1613207213820)3215692117221823(27(21)32)193114541025(22)31h137817222527H469161819H2(H3036)t2223+24?25?27?m0s1
ZINC000409414007
ZINC000409414012
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