Glycoside
...
GD029211

Name:
MOMORDICOSIDE C

Formula:
C42H72O14

Smiles:
C[C@H](CC(O)C(O)C(C)(C)O)[C@@H]1CC[C@]2(C)[C@@H]3CC=C4[C@H](CC[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H](O)[C@H]5O)C4(C)C)[C@@]3(C)CC[C@]12C

Aglycone:
CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CC=C4C(CCC(O)C4(C)C)C3(C)CCC12C

Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 10 FractionCSP3: 0.95
AlogP: 1.12 Num_rotatable_bonds: 11
MolWt: 801.02 Num_heavy_atoms: 56
TPSA: 239.22 NumAromaticRings: 0

Unique Aglycone
AD19028
Formula: C30H52O4

Smiles:
CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CC=C4C(CCC(O)C4(C)C)C3(C)CCC12C
HBA: 4 RingCount: 4
HBD: 4 FractionCSP3: 0.93
AlogP: 5.47 Num_rotatable_bonds: 5
MolWt: 476.74 Num_heavy_atoms: 34
TPSA: 80.92 NumAromaticRings: 0

Sugarmoiety
SD00070

OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O