Glycoside
GD117671
Name:
5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3-[(3,4,5-trihydroxyoxan-2-yl)peroxy]-4H-chromen-4-oneFormula:
C26H28O15Smiles:
CC1OC(Oc2cc(O)c3c(=O)c(OOC4OCC(O)C(O)C4O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1OAglycone:
O=c1c(OO)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.42 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 580.5 | Num_heavy_atoms: | 41 |
| TPSA: | 238.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD46952
Formula: C15H10O7
Smiles:
O=c1c(OO)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 120.36 | NumAromaticRings: | 3 |
