Glycoside
GD108026
Name:
Uhdoside AFormula:
C32H36O13Smiles:
C/C=C1\[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCCc3ccc(O)c(c3)Oc3ccc(cc3)CCOC(=O)C[C@H]21Aglycone:
CC=C1C(O)OC=C2C(=O)OCCc3ccc(O)c(c3)Oc3ccc(cc3)CCOC(=O)CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 628.63 | Num_heavy_atoms: | 45 |
| TPSA: | 190.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD44387
Formula: C26H26O8
Smiles:
CC=C1C(O)OC=C2C(=O)OCCc3ccc(O)c(c3)Oc3ccc(cc3)CCOC(=O)CC21| HBA: | 8 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.55 | Num_rotatable_bonds: | 0 |
| MolWt: | 466.49 | Num_heavy_atoms: | 34 |
| TPSA: | 111.52 | NumAromaticRings: | 2 |
