Glycoside
...
GD009712

Name:
None

Formula:
C30H38O11N2

Smiles:
CC(C(=O)NCCc1ccccc1)N(C(=O)CC1OC(COc2ccccc2)C(O)C(O)C1O)C(CCC(=O)O)C(=O)O

Aglycone:
CC(=O)N(C(C)C(=O)NCCc1ccccc1)C(CCC(=O)O)C(=O)O.COc1ccccc1

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 6 FractionCSP3: 0.47
AlogP: 0.2 Num_rotatable_bonds: 15
MolWt: 602.64 Num_heavy_atoms: 43
TPSA: 203.16 NumAromaticRings: 2

Unique Aglycone
AD00247
Formula: C7H8O

Smiles:
COc1ccccc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.14
AlogP: 1.7 Num_rotatable_bonds: 1
MolWt: 108.14 Num_heavy_atoms: 8
TPSA: 9.23 NumAromaticRings: 1
AD07590
Formula: C18H24O6N2

Smiles:
CC(=O)N(C(C)C(=O)NCCc1ccccc1)C(CCC(=O)O)C(=O)O
HBA: 8 RingCount: 1
HBD: 3 FractionCSP3: 0.44
AlogP: 0.9 Num_rotatable_bonds: 10
MolWt: 364.4 Num_heavy_atoms: 26
TPSA: 124.01 NumAromaticRings: 1

Sugarmoiety
SD00017

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