Vitas-M small molecule compound
(1S,5R)-3-[3-phenyl-3-(1H-pyrrol-1-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL549989
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CC(n1cccc1)c1ccccc1
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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 C24H25N3O2 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O2/c28-23-10-6-9-21-20-13-18(16-27(21)23)15-26(17-20)24(29)14-22(25-11-4-5-12-25)19-7-2-1-3-8-19/h1-12,18,20,22H,13-17H2/t18-,20+,22?/m1/s1InChIKey
RHKCDBIKLIOFDD-XAFCGNCNSA-NSynonyms
(1~(S)9~(R))11(3phenyl3pyrrol1ylpropanoyl)711diazatricyclo(7310^(27))trideca24dien6one
(1R5S)3(3phenyl3(1Hpyrrol1yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(3phenyl3(1Hpyrrol1yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
129895453
InChI=1SC24H25N3O2c2823106921201318(1627(21)23)1526(1720)24(29)1422(2511451225)197213819h112182022H1317H2t1820+22?m1s1
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CC(n1cccc1)c1ccccc1
ZINC000524731281
ZINC000524731282
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