Glycoside
GD126805
Name:
5,7-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)methyl]-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-oneFormula:
C22H22O11Smiles:
CC1OC(Cc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1OAglycone:
Cc1c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c2c1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.32 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 462.41 | Num_heavy_atoms: | 33 |
| TPSA: | 201.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD51325
Formula: C16H12O7
Smiles:
Cc1c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c2c1=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 316.27 | Num_heavy_atoms: | 23 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
