Glycoside
GD152561
Name:
2-hydroxy-4-[7-hydroxy-3,5-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-2H-chromen-2-ylidene]cyclohexa-2,5-dien-1-oneFormula:
C27H30O16Smiles:
O=C1C=CC(=C2Oc3cc(O)cc(OC4OC(CO)C(O)C(O)C4O)c3C=C2OC2OC(CO)C(O)C(O)C2O)C=C1OAglycone:
O=C1C=CC(=C2Oc3cc(O)cc(O)c3C=C2O)C=C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.44 |
| AlogP: | -3.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 610.52 | Num_heavy_atoms: | 43 |
| TPSA: | 265.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD54194
Formula: C15H10O6
Smiles:
O=C1C=CC(=C2Oc3cc(O)cc(O)c3C=C2O)C=C1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 0 |
| MolWt: | 286.24 | Num_heavy_atoms: | 21 |
| TPSA: | 107.22 | NumAromaticRings: | 1 |
