| 2D Structure | |
| CID | 45359883 |
| IUPAC Name | [(2S,3R,4S,5S,6R)-2-[[(3S,4R,4aR)-4-ethenyl-4a-hydroxy-8-oxo-3,4,5,6-tetrahydropyrano[3,4-c]pyran-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 2,4-dihydroxy-6-(3-hydroxyphenyl)benzoate |
| InChI | InChI=1S/C29H30O14/c1-2-17-27(40-12-18-25(36)39-7-6-29(17,18)38)43-28-24(23(35)22(34)20(11-30)41-28)42-26(37)21-16(9-15(32)10-19(21)33)13-4-3-5-14(31)8-13/h2-5,8-10,12,17,20,22-24,27-28,30-35,38H,1,6-7,11H2/t17-,20+,22+,23-,24+,27-,28-,29+/m0/s1 |
| InChI Key | UZYZCCWBBBCDAD-WCYQFIIKSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C29H30O14 |
| Molecular Weight | 602.5 |
| synonyms | ['Amaroswerin', '21233-18-1', '[(2S,3R,4S,5S,6R)-2-[[(3S,4R,4aR)-4-ethenyl-4a-hydroxy-8-oxo-3,4,5,6-tetrahydropyrano[3,4-c]pyran-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 2,4-dihydroxy-6-(3-hydroxyphenyl)benzoate', '((2S,3R,4S,5S,6R)-2-(((3S,4R,4aR)-4-ethenyl-4a-hydroxy-8-oxo-3,4,5,6-tetrahydropyrano(3,4-c)pyran-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl) 2,4-dihydroxy-6-(3-hydroxyphenyl)benzoate', "1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-4,4a,5,6-tetrahydro-4a-hydroxy-6-[[2-O-[(3,3',5-trihydroxy[1,1'-biphenyl]-2-yl)carbonyl]-beta-D-glucopyranosyl]oxy]-, (4aR,5R,6S)-", 'orb1981758', 'SCHEMBL29655256', 'CHEBI:81152', 'HY-N9337', 'DA-50381', 'CS-0159478', 'C17519', 'Q27155107', '1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-4,4a,5,6-tetrahydro-4a-hydroxy-6-[[2-O-[(3,3 inverted exclamation marka,5-trihydroxy[1,1 inverted exclamation marka-biphenyl]-2-yl)carbonyl]-|A-D-glucopyranosyl]oxy]-, (4aR,5R,6S)-'] |
From Pubchem