Glycoside
GD155161
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 14-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,15-tetraenoateFormula:
C38H62O19Smiles:
C=CC(C)(CCC=C(C)CCC=C(C)CC(O)C=C(C)C(=O)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC=C(C)CCC=C(C)CC(O)C=C(C)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 3 |
| HBD: | 12 | FractionCSP3: | 0.76 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 19 |
| MolWt: | 822.9 | Num_heavy_atoms: | 57 |
| TPSA: | 315.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD45777
Formula: C20H32O4
Smiles:
C=CC(C)(O)CCC=C(C)CCC=C(C)CC(O)C=C(C)C(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | 4.16 | Num_rotatable_bonds: | 11 |
| MolWt: | 336.47 | Num_heavy_atoms: | 24 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
