Vitas-M small molecule compound
(1S,5R)-3-[(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL534816
SMILES Oc1cc(O)c2c(c1)oc(=O)c(c2C)CC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C23H22N2O6 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6/c1-12-16(23(30)31-19-7-15(26)6-18(27)22(12)19)8-21(29)24-9-13-5-14(11-24)17-3-2-4-20(28)25(17)10-13/h2-4,6-7,13-14,26-27H,5,8-11H2,1H3/t13-,14+/m0/s1InChIKey
MRHGRUMYGYKQRC-UONOGXRCSA-NSynonyms
(1R5S)3(2(57dihydroxy4methyl2oxo2Hchromen3yl)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3((57dihydroxy4methyl2oxo2Hchromen3yl)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC23H22N2O6c11216(23(30)3119715(26)618(27)22(12)19)821(29)24913514(1124)1732420(28)25(17)1013h246713142627H5811H21H3t1314+m0s1
MFCD08284227
Oc1cc(O)c2c(c1)oc(=O)c(c2C)CC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000008878927
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