Glycoside
...
GD154375

Name:
None

Formula:
C33H36O12N2

Smiles:
Nc1ccc(CCOc2ccc(-c3cc(=O)c4c(O)c(OC5CCCCC5)c(OC5OC(C(=O)O)C(O)C(O)C5O)cc4o3)cc2)[nH]1

Aglycone:
Nc1ccc(CCOc2ccc(-c3cc(=O)c4c(O)c(OC5CCCCC5)c(O)cc4o3)cc2)[nH]1

Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 8 FractionCSP3: 0.39
AlogP: 2.68 Num_rotatable_bonds: 10
MolWt: 652.65 Num_heavy_atoms: 47
TPSA: 227.16 NumAromaticRings: 4

Unique Aglycone
AD50164
Formula: C27H28O6N2

Smiles:
Nc1ccc(CCOc2ccc(-c3cc(=O)c4c(O)c(OC5CCCCC5)c(O)cc4o3)cc2)[nH]1
HBA: 8 RingCount: 5
HBD: 5 FractionCSP3: 0.3
AlogP: 5.11 Num_rotatable_bonds: 7
MolWt: 476.53 Num_heavy_atoms: 35
TPSA: 130.94 NumAromaticRings: 4

Sugarmoiety
SD00030

O=C(O)C1OC(O)C(O)C(O)C1O