| 2D Structure | |
| CID | 442057 |
| IUPAC Name | (1R,4S,12R,13S,14S,16S,17R,18R)-14,17,18-trihydroxy-12-methyl-17-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6-dien-10-one |
| InChI | InChI=1S/C26H36O11/c1-24-8-15(29)20-12(3-5-35-20)13(24)2-4-25-7-11(6-14(28)21(24)25)26(34,23(25)33)10-36-22-19(32)18(31)17(30)16(9-27)37-22/h3,5,11,13-14,16-19,21-23,27-28,30-34H,2,4,6-10H2,1H3/t11-,13-,14+,16-,17-,18+,19-,21+,22-,23-,24-,25-,26+/m1/s1 |
| InChI Key | SJBDVPKAXKLGPV-UKNYEQEFSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C26H36O11 |
| Molecular Weight | 524.6 |
| synonyms | ['Mascaroside', '55465-97-9', 'C09132', '(1R,4S,12R,13S,14S,16S,17R,18R)-14,17,18-trihydroxy-12-methyl-17-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6-dien-10-one', 'AC1L9C6H', 'CHEBI:6697', 'DTXSID50331730', 'Q27107303'] |
From Pubchem