Glycoside
GD003574
Name:
NoneFormula:
C37H58O15Smiles:
CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](OC2OC(C)C(O)C(=O)C2O)[C@H](CC=O)C[C@H](C)C(=O)C=CC(C)=C[C@H]1COC1OC(C)C(O)C(OC)C1OCAglycone:
CCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(O)C(=O)C2O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 10 |
| MolWt: | 742.86 | Num_heavy_atoms: | 52 |
| TPSA: | 213.81 | NumAromaticRings: | 0 |
Unique Aglycone
AD03232
Formula: C29H44O11
Smiles:
CCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(O)C(=O)C2O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1CO| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 568.66 | Num_heavy_atoms: | 40 |
| TPSA: | 176.89 | NumAromaticRings: | 0 |
