Glycoside
...
GD120779

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

Formula:
C39H60O10

Smiles:
CC(=O)OC1CC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C(=O)O)CCC23C)C(C)(C)C1OC1OCC(O)C(OC(C)=O)C1O

Aglycone:
CC(=O)OC1CC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C(=O)O)CCC23C)C(C)(C)C1O

Sugarmoiety:
CC(=O)OC1C(O)COC(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 3 FractionCSP3: 0.87
AlogP: 5.81 Num_rotatable_bonds: 5
MolWt: 688.9 Num_heavy_atoms: 49
TPSA: 148.82 NumAromaticRings: 0

Unique Aglycone
AD46966
Formula: C32H50O5

Smiles:
CC(=O)OC1CC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C(=O)O)CCC23C)C(C)(C)C1O
HBA: 5 RingCount: 5
HBD: 2 FractionCSP3: 0.88
AlogP: 6.78 Num_rotatable_bonds: 2
MolWt: 514.75 Num_heavy_atoms: 37
TPSA: 83.83 NumAromaticRings: 0

Sugarmoiety
SD00516

CC(=O)OC1C(O)COC(O)C1O