Glycoside
...
GD149552

Name:
6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 10-hydroxy-2-(hydroxymethyl)-6a,6b,9,9,12a-pentamethyl-1,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a-carboxylate

Formula:
C47H74O18

Smiles:
CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CC=C(CO)CC4C4=CCC6C7(C)CCC(O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Aglycone:
CC1(C)C(O)CCC2(C)C1CCC1(C)C2CC=C2C3CC(CO)=CCC3(C(=O)O)CCC21C

Sugarmoiety:
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 11 FractionCSP3: 0.89
AlogP: -0.33 Num_rotatable_bonds: 9
MolWt: 927.09 Num_heavy_atoms: 65
TPSA: 294.98 NumAromaticRings: 0

Unique Aglycone
AD59790
Formula: C29H44O4

Smiles:
CC1(C)C(O)CCC2(C)C1CCC1(C)C2CC=C2C3CC(CO)=CCC3(C(=O)O)CCC21C
HBA: 4 RingCount: 5
HBD: 3 FractionCSP3: 0.83
AlogP: 5.74 Num_rotatable_bonds: 2
MolWt: 456.67 Num_heavy_atoms: 33
TPSA: 77.76 NumAromaticRings: 0

Sugarmoiety
SD00047

CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O