| 2D Structure | |
| CID | 91884898 |
| IUPAC Name | methyl (2S,4aS,6R,6aR,9R,10aS,10bS)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate |
| InChI | InChI=1S/C27H36O12/c1-26-9-16(12-4-5-36-11-12)37-24(34)14(26)8-19(39-25-22(32)21(31)20(30)17(10-28)38-25)27(2)15(23(33)35-3)6-13(29)7-18(26)27/h4-6,11,13-14,16-22,25,28-32H,7-10H2,1-3H3/t13-,14+,16-,17+,18-,19+,20+,21-,22+,25-,26+,27-/m0/s1 |
| InChI Key | XUOAZZCHOKUHCF-FVAQCFFJSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C27H36O12 |
| Molecular Weight | 552.6 |
| synonyms | ['borapetoside B', '104901-05-5', 'methyl (2S,4aS,6R,6aR,9R,10aS,10bS)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate', 'orb1683052', 'AKOS032948271', 'CS-0023580', 'Methyl (2S,4aS,6R,6aR,9R,10aS,10bS)-2-(3-furanyl)-6-(|A-D-glucopyranosyloxy)-1,4,4a,5,6,6a,9,10,10a,10b-decahydro-9-hydroxy-6a,10b-dimethyl-4-oxo-2H-naphtho[2,1-c]pyran-7-carboxylate', 'Methyl (2S,4aS,6R,6aR,9R,10aS,10bS)-2-(3-furanyl)-6-(beta-D-glucopyranosyloxy)-1,4,4a,5,6,6a,9,10,10a,10b-decahydro-9-hydroxy-6a,10b-dimethyl-4-oxo-2H-naphtho[2,1-c]pyran-7-carboxylate'] |
From Pubchem