Glycoside

GD148329
Name:
Cuscutic Acid CFormula:
C38H68O20Smiles:
CCCC(CCCCCCCCCC(=O)O)OC1OC(C)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OAglycone:
CCCC(O)CCCCCCCCCC(=O)OSugarmoiety:
CC1OC(OC2C(O)C(C)OC(OC3C(OC4C(O)OC(C)C(O)C4O)OC(CO)C(O)C3O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 20 | RingCount: | 4 |
HBD: | 11 | FractionCSP3: | 0.97 |
AlogP: | -1.88 | Num_rotatable_bonds: | 21 |
MolWt: | 844.94 | Num_heavy_atoms: | 58 |
TPSA: | 313.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD06792
Formula: C14H28O3
Smiles:
CCCC(O)CCCCCCCCCC(=O)OHBA: | 3 | RingCount: | 0 |
HBD: | 2 | FractionCSP3: | 0.93 |
AlogP: | 3.74 | Num_rotatable_bonds: | 12 |
MolWt: | 244.37 | Num_heavy_atoms: | 17 |
TPSA: | 57.53 | NumAromaticRings: | 0 |