Glycoside

GD148242
Name:
2-{[(2-methylbut-3-en-2-yl)oxy]methyl}-6-{[4,9,14-trihydroxy-14-(methoxymethyl)-3,10-dimethyl-6-(propan-2-yl)tricyclo[9.3.0.0³,â·]tetradeca-1,6-dien-8-yl]oxy}oxane-3,4,5-triolFormula:
C32H52O10Smiles:
C=CC(C)(C)OCC1OC(OC2C3=C(C(C)C)CC(O)C3(C)C=C3C(CCC3(O)COC)C(C)C2O)C(O)C(O)C1OAglycone:
C=CC(C)(C)OC.COCC1(O)CCC2C1=CC1(C)C(=C(C(C)C)CC1O)C(O)C(O)C2CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 6 | FractionCSP3: | 0.81 |
AlogP: | 1.61 | Num_rotatable_bonds: | 9 |
MolWt: | 596.76 | Num_heavy_atoms: | 42 |
TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD23211
Formula: C6H12O
Smiles:
C=CC(C)(C)OCHBA: | 1 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 1.6 | Num_rotatable_bonds: | 2 |
MolWt: | 100.16 | Num_heavy_atoms: | 7 |
TPSA: | 9.23 | NumAromaticRings: | 0 |
AD59328
Formula: C21H34O5
Smiles:
COCC1(O)CCC2C1=CC1(C)C(=C(C(C)C)CC1O)C(O)C(O)C2CHBA: | 5 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.81 |
AlogP: | 1.8 | Num_rotatable_bonds: | 3 |
MolWt: | 366.5 | Num_heavy_atoms: | 26 |
TPSA: | 90.15 | NumAromaticRings: | 0 |