Glycoside
GD118980
Name:
3-hydroxy-4,5-dimethyl-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl 2,6,11,15-tetramethyl-16-oxohexadeca-2,4,6,8,10,12,14-heptaenoateFormula:
C34H48O11Smiles:
CC(C=O)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C(=O)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(C)C(C)C1OAglycone:
CC(C=O)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C(=O)OC1OC(CO)C(C)C(C)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 13 |
| MolWt: | 632.75 | Num_heavy_atoms: | 45 |
| TPSA: | 172.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD47614
Formula: C28H38O6
Smiles:
CC(C=O)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C(=O)OC1OC(CO)C(C)C(C)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 4.53 | Num_rotatable_bonds: | 10 |
| MolWt: | 470.61 | Num_heavy_atoms: | 34 |
| TPSA: | 93.06 | NumAromaticRings: | 0 |
