Vitas-M small molecule compound
(1S,5R)-3-{[(4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]acetyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL534733
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)COc1ccc2c(c1)oc(=O)c1c2CCC1
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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 C25H24N2O5 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O5/c28-23-6-2-5-21-16-9-15(12-27(21)23)11-26(13-16)24(29)14-31-17-7-8-19-18-3-1-4-20(18)25(30)32-22(19)10-17/h2,5-8,10,15-16H,1,3-4,9,11-14H2/t15-,16+/m0/s1InChIKey
NAEZQNRJBHPTCW-JKSUJKDBSA-NSynonyms
(1R5S)3(2((4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(((4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC25H24N2O5c28236252116915(1227(21)23)1126(1316)24(29)14311778191831420(18)25(30)3222(19)1017h258101516H13491114H2t1516+m0s1
MFCD08283378
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)COc1ccc2c(c1)oc(=O)c1c2CCC1
ZINC000008877292
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