Glycoside
...
GD003864

Name:
None

Formula:
C30H31O10N3

Smiles:
COC1C(OC(=O)c2[nH]cnc2C)C(O)C(Oc2ccc3c(O)c(NC(=O)c4ccccc4)c(=O)oc3c2C)OC1(C)C

Aglycone:
Cc1c(O)ccc2c(O)c(NC(=O)c3ccccc3)c(=O)oc12.Cc1nc[nH]c1C(=O)O

Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)C

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 4 FractionCSP3: 0.33
AlogP: 3.21 Num_rotatable_bonds: 7
MolWt: 593.59 Num_heavy_atoms: 43
TPSA: 182.44 NumAromaticRings: 4

Unique Aglycone
AD03445
Formula: C17H13O5N

Smiles:
Cc1c(O)ccc2c(O)c(NC(=O)c3ccccc3)c(=O)oc12
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.06
AlogP: 2.76 Num_rotatable_bonds: 2
MolWt: 311.29 Num_heavy_atoms: 23
TPSA: 99.77 NumAromaticRings: 3
AD03446
Formula: C5H6O2N2

Smiles:
Cc1nc[nH]c1C(=O)O
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.2
AlogP: 0.42 Num_rotatable_bonds: 1
MolWt: 126.11 Num_heavy_atoms: 9
TPSA: 65.98 NumAromaticRings: 1

Sugarmoiety
SD00066

COC1C(O)C(O)C(O)OC1(C)C