Glycoside
GD156894
Name:
chrysoeriol-7-o-beta-d-glucuronopyranoside-(4'-o-Formula:
C43H36O22Smiles:
COc1cc(-c2cc(=O)c3c(O)cc(OC4OC(C(=O)O)C(O)C(O)C4O)cc3o2)ccc1Oc1ccc(-c2cc(=O)c3c(O)cc(OC4OC(C(=O)O)C(O)C(O)C4O)cc3o2)cc1Aglycone:
COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1Oc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O.O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 8 |
| HBD: | 10 | FractionCSP3: | 0.26 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 11 |
| MolWt: | 904.74 | Num_heavy_atoms: | 65 |
| TPSA: | 352.24 | NumAromaticRings: | 6 |
Unique Aglycone
AD62081
Formula: C31H20O10
Smiles:
COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1Oc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.03 |
| AlogP: | 5.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 552.49 | Num_heavy_atoms: | 41 |
| TPSA: | 159.8 | NumAromaticRings: | 6 |
