Glycoside
GD024769
Name:
VIRIDAPHIN A1 GLUCOSIDEFormula:
C36H34O15Smiles:
C[C@@H]1O[C@H](C)Cc2c1c(O)c1c(=O)cc3oc4c(O)cc(O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)c5c(=O)c6c7c(c45)c3c1c2O[C@@]7(O)[C@H](C)O[C@H]6CAglycone:
CC1Cc2c(c(O)c3c(=O)cc4oc5c(O)cc(O)c6c(=O)c7c8c(c56)c4c3c2OC8(O)C(C)OC7C)C(C)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 9 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 706.65 | Num_heavy_atoms: | 51 |
| TPSA: | 235.04 | NumAromaticRings: | 5 |
Unique Aglycone
AD16501
Formula: C30H24O10
Smiles:
CC1Cc2c(c(O)c3c(=O)cc4oc5c(O)cc(O)c6c(=O)c7c8c(c56)c4c3c2OC8(O)C(C)OC7C)C(C)O1| HBA: | 10 | RingCount: | 8 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 4.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 544.51 | Num_heavy_atoms: | 40 |
| TPSA: | 155.89 | NumAromaticRings: | 5 |
