Glycoside
GD148105
Name:
Nidurufin-2'-(4-O-Methyl)-Î’-D-GlucopyranoseFormula:
C27H28O13Smiles:
COC1C(CO)OC(OC2CCC3(C)Oc4cc5c(c(O)c4C2O3)C(=O)c2c(O)cc(O)cc2C5=O)C(O)C1OAglycone:
CC12CCC(O)C(O1)c1c(cc3c(c1O)C(=O)c1c(O)cc(O)cc1C3=O)O2Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.48 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 560.51 | Num_heavy_atoms: | 40 |
| TPSA: | 201.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD59280
Formula: C20H16O8
Smiles:
CC12CCC(O)C(O1)c1c(cc3c(c1O)C(=O)c1c(O)cc(O)cc1C3=O)O2| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 384.34 | Num_heavy_atoms: | 28 |
| TPSA: | 133.52 | NumAromaticRings: | 2 |
