Glycoside
...
GD140543

Name:
catechin(4alpha->8)pelargonidin 3-o-beta-glucopyranoside

Formula:
C36H35O16

Smiles:
Oc1ccc(C2Oc3c(c(O)cc(O)c3C3c4c(O)cc(O)cc4OC(c4ccc(O)c(O)c4)C3O)C=C2OC2OC(C[OH2+])C(O)C(O)C2O)cc1

Aglycone:
OC1=Cc2c(O)cc(O)c(C3c4c(O)cc(O)cc4OC(c4ccc(O)c(O)c4)C3O)c2OC1c1ccc(O)cc1

Sugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 7
HBD: 13 FractionCSP3: 0.28
AlogP: 1.28 Num_rotatable_bonds: 6
MolWt: 723.66 Num_heavy_atoms: 52
TPSA: 282.35 NumAromaticRings: 4

Unique Aglycone
AD56665
Formula: C30H24O11

Smiles:
OC1=Cc2c(O)cc(O)c(C3c4c(O)cc(O)cc4OC(c4ccc(O)c(O)c4)C3O)c2OC1c1ccc(O)cc1
HBA: 11 RingCount: 6
HBD: 9 FractionCSP3: 0.13
AlogP: 4.28 Num_rotatable_bonds: 3
MolWt: 560.51 Num_heavy_atoms: 41
TPSA: 200.53 NumAromaticRings: 4

Sugarmoiety
SD04392

OC1OC(C[OH2+])C(O)C(O)C1O