Glycoside
GD034103
Name:
NoneFormula:
C27H31O6ClSmiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc(C4CCC4)cc3)c(Cl)c3c2OCCC3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1c(Cc2ccc(C3CCC3)cc2)ccc2c1CCCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 474.98 | Num_heavy_atoms: | 33 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD21714
Formula: C21H21OCl
Smiles:
Clc1c(Cc2ccc(C3CCC3)cc2)ccc2c1CCCO2| HBA: | 1 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 5.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 312.84 | Num_heavy_atoms: | 22 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
