Glycoside
...
GD109987

Name:
[3,4,5-tris(acetyloxy)-6-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)oxan-2-yl]methyl acetate

Formula:
C28H29O12Cl

Smiles:
CC(=O)OC[C@H]1O[C@@H](Oc2cc3oc(=O)c4c(c3cc2Cl)CCCC4)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.O=c1oc2cc(O)c(Cl)cc2c2c1CCCC2

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 0 FractionCSP3: 0.52
AlogP: 2.79 Num_rotatable_bonds: 7
MolWt: 580.97 Num_heavy_atoms: 40
TPSA: 153.87 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD38137
Formula: C14H11O3Cl

Smiles:
O=c1oc2cc(O)c(Cl)cc2c2c1CCCC2
HBA: 3 RingCount: 3
HBD: 1 FractionCSP3: 0.31
AlogP: 3.03 Num_rotatable_bonds: 0
MolWt: 250.68 Num_heavy_atoms: 17
TPSA: 50.44 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O