Glycoside
...
GD123641

Name:
10-[(3,4-dihydroxy-5-methoxy-6-methyloxan-2-yl)oxy]-20-{[2,4-dihydroxy-6-(2-hydroxy-3-methoxypropyl)-3,5-dimethyloxan-2-yl]methyl}-18-methoxy-3,5,7,9,13-pentamethyl-1-oxacycloicosa-3,5,7,11,13-pentaen-2-one

Formula:
C44H72O13

Smiles:
COCC(O)CC1OC(O)(CC2CC(OC)CCCC=C(C)C=CC(OC3OC(C)C(OC)C(O)C3O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C

Aglycone:
COCC(O)CC1OC(O)(CC2CC(OC)CCCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C

Sugarmoiety:
COC1C(C)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 5 FractionCSP3: 0.75
AlogP: 4.84 Num_rotatable_bonds: 10
MolWt: 809.05 Num_heavy_atoms: 57
TPSA: 182.83 NumAromaticRings: 0

Unique Aglycone
AD49914
Formula: C37H60O9

Smiles:
COCC(O)CC1OC(O)(CC2CC(OC)CCCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C
HBA: 9 RingCount: 2
HBD: 4 FractionCSP3: 0.7
AlogP: 5.33 Num_rotatable_bonds: 7
MolWt: 648.88 Num_heavy_atoms: 46
TPSA: 134.91 NumAromaticRings: 0

Sugarmoiety
SD00158

COC1C(C)OC(O)C(O)C1O