Glycoside
...
GD017907

Name:
CYPELLOCARPA C

Formula:
C26H32O11

Smiles:
Cc1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](COC(=O)C4=CC[C@H](C(C)(C)O)CC4)[C@H](O)[C@H](O)[C@H]3O)cc2o1

Aglycone:
COC(=O)C1=CCC(C(C)(C)O)CC1.Cc1cc(=O)c2c(O)cc(O)cc2o1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 5 FractionCSP3: 0.54
AlogP: 1.03 Num_rotatable_bonds: 6
MolWt: 520.53 Num_heavy_atoms: 37
TPSA: 176.12 NumAromaticRings: 2

Unique Aglycone
AD04696
Formula: C11H18O3

Smiles:
COC(=O)C1=CCC(C(C)(C)O)CC1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.73
AlogP: 1.66 Num_rotatable_bonds: 2
MolWt: 198.26 Num_heavy_atoms: 14
TPSA: 46.53 NumAromaticRings: 0
AD05146
Formula: C10H8O4

Smiles:
Cc1cc(=O)c2c(O)cc(O)cc2o1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.1
AlogP: 1.51 Num_rotatable_bonds: 0
MolWt: 192.17 Num_heavy_atoms: 14
TPSA: 70.67 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O