Glycoside
...
GD157375

Name:
Cotylenin F

Formula:
C33H54O11

Smiles:
COCC1OC(OC2C3=C(C(C)C)CCC3(C)C=C3C(CCC3(O)COC)C(C)C2O)C(O)C(O)C1OC(C)(CO)C1CO1

Aglycone:
CC(O)(CO)C1CO1.COCC1(O)CCC2C1=CC1(C)CCC(C(C)C)=C1C(O)C(O)C2C

Sugarmoiety:
COCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 5
HBD: 5 FractionCSP3: 0.88
AlogP: 1.48 Num_rotatable_bonds: 11
MolWt: 626.78 Num_heavy_atoms: 44
TPSA: 159.83 NumAromaticRings: 0

Unique Aglycone
AD52053
Formula: C21H34O4

Smiles:
COCC1(O)CCC2C1=CC1(C)CCC(C(C)C)=C1C(O)C(O)C2C
HBA: 4 RingCount: 3
HBD: 3 FractionCSP3: 0.81
AlogP: 2.82 Num_rotatable_bonds: 3
MolWt: 350.5 Num_heavy_atoms: 25
TPSA: 69.92 NumAromaticRings: 0
AD62224
Formula: C5H10O3

Smiles:
CC(O)(CO)C1CO1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 1.0
AlogP: -0.87 Num_rotatable_bonds: 2
MolWt: 118.13 Num_heavy_atoms: 8
TPSA: 52.99 NumAromaticRings: 0

Sugarmoiety
SD00991

COCC1OC(O)C(O)C(O)C1O