Glycoside
GD149009
Name:
hirsutidin 3-glucosideFormula:
C24H29O12Smiles:
COc1cc(O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(OC1OC(C[OH2+])C(O)C(O)C1O)=C2Aglycone:
COc1cc(O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(O)=C2Sugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.42 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 7 |
| MolWt: | 509.48 | Num_heavy_atoms: | 36 |
| TPSA: | 179.43 | NumAromaticRings: | 2 |
Unique Aglycone
AD59438
Formula: C18H18O7
Smiles:
COc1cc(O)c2c(c1)OC(c1cc(OC)c(O)c(OC)c1)C(O)=C2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 3.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.34 | Num_heavy_atoms: | 25 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
