Glycoside
...
GD152256

Name:
5-{[4,5-dihydroxy-6-(2-hydroxyethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-6-({9-[(2,5-dihydroxy-6-methyl-3,4-dihydro-2H-pyran-4-yl)oxy]-8a-formyl-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl}oxy)-3,4-dihydroxyoxane-2-carboxylic acid

Formula:
C55H86O22

Smiles:
CC1=C(O)C(OC2CC(C)(C)CC3C4=CCC5C6(C)CCC(OC7OC(C(=O)O)C(O)C(O)C7OC7OC(CCO)C(O)C(O)C7OC7OC(C)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C4(C)CCC23C=O)CC(O)O1

Aglycone:
CC1=C(O)C(OC2CC(C)(C)CC3C4=CCC5C6(C)CCC(O)C(C)(CO)C6CCC5(C)C4(C)CCC23C=O)CC(O)O1

Sugarmoiety:
CC1OC(OC2C(OC3C(O)OC(C(=O)O)C(O)C3O)OC(CCO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 22 RingCount: 9
HBD: 12 FractionCSP3: 0.89
AlogP: 1.19 Num_rotatable_bonds: 13
MolWt: 1099.27 Num_heavy_atoms: 77
TPSA: 350.74 NumAromaticRings: 0

Unique Aglycone
AD60638
Formula: C36H56O7

Smiles:
CC1=C(O)C(OC2CC(C)(C)CC3C4=CCC5C6(C)CCC(O)C(C)(CO)C6CCC5(C)C4(C)CCC23C=O)CC(O)O1
HBA: 7 RingCount: 6
HBD: 4 FractionCSP3: 0.86
AlogP: 6.21 Num_rotatable_bonds: 4
MolWt: 600.84 Num_heavy_atoms: 43
TPSA: 116.45 NumAromaticRings: 0

Sugarmoiety
SD10002

CC1OC(OC2C(OC3C(O)OC(C(=O)O)C(O)C3O)OC(CCO)C(O)C2O)C(O)C(O)C1O