Glycoside
GD128450
Name:
methyl 3-hydroxy-2,4,6,8,10,12,14-heptamethyl-7,11-bis[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)oxy]hexadeca-4,8,12-trienoateFormula:
C36H62O15Smiles:
CCC(C)C=C(C)C(OC1OC(OC)C(O)C(O)C1O)C(C)C=C(C)C(OC1OC(OC)C(O)C(O)C1O)C(C)C=C(C)C(O)C(C)C(=O)OCAglycone:
CCC(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)C(=O)OCSugarmoiety:
COC1OC(O)C(O)C(O)C1O.COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.81 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 17 |
| MolWt: | 734.88 | Num_heavy_atoms: | 51 |
| TPSA: | 223.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD51425
Formula: C24H42O5
Smiles:
CCC(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)C(=O)OC| HBA: | 5 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 4.04 | Num_rotatable_bonds: | 11 |
| MolWt: | 410.6 | Num_heavy_atoms: | 29 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
