Vitas-M small molecule compound
(1S,5S)-3-[3-(benzyloxy)-2-hydroxypropyl]-8-oxo-1,3,4,5,6,8-hexahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3-ium
Catalog ID
STL553195
SMILES OC(C[NH+]1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)COCc1ccccc1
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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 C21H27N2O3 MW 355.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3/c24-19(15-26-14-16-5-2-1-3-6-16)13-22-10-17-9-18(12-22)20-7-4-8-21(25)23(20)11-17/h1-8,17-19,24H,9-15H2/p+1/t17-,18+,19?/m0/s1InChIKey
RNQFBQHVXRAHLH-PAMZHZACSA-OSynonyms
(1~(R)9~(R))11(2hydroxy3phenylmethoxypropyl)7aza11azoniatricyclo(7310^(27))trideca24dien6one
(1S5S)3(3(benzyloxy)2hydroxypropyl)8oxo134568hexahydro2H15methanopyrido(12a)(15)diazocin3ium
135640897
InChI=1SC21H26N2O3c2419(152614165213616)13221017918(1222)2074821(25)23(20)1117h18171924H915H2p+1t1718+19?m0s1
ZINC000006733565
ZINC000006733566
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