Glycoside
...
GD117075

Name:
5-hydroxy-1-(3-{4-hydroxy-3-[(1H-imidazol-5-yl)methyl]phenyl}prop-2-enoyl)-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1H-indole-2-carboxylic acid

Formula:
C28H29O11N3

Smiles:
O=C(O)C1Cc2cc(O)c(OC3OC(CO)C(O)C(O)C3O)cc2N1C(=O)C=Cc1ccc(O)c(Cc2cnc[nH]2)c1

Aglycone:
O=C(O)C1Cc2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)c(Cc2cnc[nH]2)c1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 5
HBD: 8 FractionCSP3: 0.32
AlogP: -0.35 Num_rotatable_bonds: 8
MolWt: 583.55 Num_heavy_atoms: 42
TPSA: 226.13 NumAromaticRings: 3

Unique Aglycone
AD46621
Formula: C22H19O6N3

Smiles:
O=C(O)C1Cc2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)c(Cc2cnc[nH]2)c1
HBA: 9 RingCount: 4
HBD: 5 FractionCSP3: 0.14
AlogP: 2.17 Num_rotatable_bonds: 5
MolWt: 421.41 Num_heavy_atoms: 31
TPSA: 146.98 NumAromaticRings: 3

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O