Glycoside
...
GD142450

Name:
Arenaric Acid

Formula:
C41H68O15

Smiles:
COC1CC(CC2OC(O)(C(O)C(=O)O)C(C)C(OC)C2(C)OC)OC2(OC(C)(C3CCC(C4CCC(C(O)C(C)C=C(C)C(C)=O)O4)O3)C(OC)C2C)C1C

Aglycone:
COC1CC(C)OC2(OC(C)(C3CCC(C4CCC(C(O)C(C)C=C(C)C(C)=O)O4)O3)C(OC)C2C)C1C.O=C(O)CO

Sugarmoiety:
COC1C(C)C(O)(O)OC(O)C1(C)OC

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 4 FractionCSP3: 0.9
AlogP: 3.17 Num_rotatable_bonds: 14
MolWt: 800.98 Num_heavy_atoms: 56
TPSA: 198.13 NumAromaticRings: 0

Unique Aglycone
AD02329
Formula: C2H4O3

Smiles:
O=C(O)CO
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 0.5
AlogP: -0.94 Num_rotatable_bonds: 1
MolWt: 76.05 Num_heavy_atoms: 5
TPSA: 57.53 NumAromaticRings: 0
AD57322
Formula: C30H50O8

Smiles:
COC1CC(C)OC2(OC(C)(C3CCC(C4CCC(C(O)C(C)C=C(C)C(C)=O)O4)O3)C(OC)C2C)C1C
HBA: 8 RingCount: 4
HBD: 1 FractionCSP3: 0.9
AlogP: 4.21 Num_rotatable_bonds: 8
MolWt: 538.72 Num_heavy_atoms: 38
TPSA: 92.68 NumAromaticRings: 0

Sugarmoiety
SD05716

COC1C(C)C(O)(O)OC(O)C1(C)OC