Glycoside
...
GD156454

Name:
Urdamycin F

Formula:
C43H58O18

Smiles:
CC1OC(OC23C(=O)CC(C)(O)CC2(O)CC(O)C2=C3C(=O)c3ccc(C4CC(OC5CCC(OC6CC(O)C(O)C(C)O6)C(C)O5)C(O)C(C)O4)c(O)c3C2=O)CCC1O

Aglycone:
CC1OC(OC2CC(c3ccc4c(c3O)C(=O)C3=C(C4=O)C4(OC5CCC(O)C(C)O5)C(=O)CC(C)(O)CC4(O)CC3O)OC(C)C2O)CCC1O

Sugarmoiety:
CC1OC(O)CC(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 8 FractionCSP3: 0.74
AlogP: 0.68 Num_rotatable_bonds: 7
MolWt: 862.92 Num_heavy_atoms: 61
TPSA: 277.66 NumAromaticRings: 1

Unique Aglycone
AD61953
Formula: C37H48O15

Smiles:
CC1OC(OC2CC(c3ccc4c(c3O)C(=O)C3=C(C4=O)C4(OC5CCC(O)C(C)O5)C(=O)CC(C)(O)CC4(O)CC3O)OC(C)C2O)CCC1O
HBA: 15 RingCount: 7
HBD: 7 FractionCSP3: 0.7
AlogP: 0.8 Num_rotatable_bonds: 5
MolWt: 732.78 Num_heavy_atoms: 52
TPSA: 238.97 NumAromaticRings: 1

Sugarmoiety
SD00010

CC1OC(O)CC(O)C1O