Glycoside
...
GD128594

Name:
4a-({[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]oxy}carbonyl)-2,6b,9,9,12a,14b-hexamethyl-10-oxo-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-icosahydropicene-2-carboxylic acid

Formula:
C48H74O19

Smiles:
CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CC=C6C(CCC7C6(C)CCC6C(C)(C)C(=O)CCC67C)C4(C)CC(C)(C(=O)O)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Aglycone:
CC1(C(=O)O)CCC2(C(=O)O)CC=C3C(CCC4C3(C)CCC3C(C)(C)C(=O)CCC34C)C2(C)C1

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

Other Identifiers

Properties
HBA: 19 RingCount: 8
HBD: 10 FractionCSP3: 0.9
AlogP: 0.44 Num_rotatable_bonds: 9
MolWt: 955.1 Num_heavy_atoms: 67
TPSA: 308.89 NumAromaticRings: 0

Unique Aglycone
AD52091
Formula: C30H44O5

Smiles:
CC1(C(=O)O)CCC2(C(=O)O)CC=C3C(CCC4C3(C)CCC3C(C)(C)C(=O)CCC34C)C2(C)C1
HBA: 5 RingCount: 5
HBD: 2 FractionCSP3: 0.83
AlogP: 6.51 Num_rotatable_bonds: 2
MolWt: 484.68 Num_heavy_atoms: 35
TPSA: 91.67 NumAromaticRings: 0

Sugarmoiety
SD00047

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