Glycoside
...
GD133022

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

Formula:
C31H35O12N3

Smiles:
O=C(C=Cc1ccc(O)c(Cc2cnc[nH]2)c1)N1c2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2CC1(CCCO)C(=O)O

Aglycone:
O=C(C=Cc1ccc(O)c(Cc2cnc[nH]2)c1)N1c2cc(O)c(O)cc2CC1(CCCO)C(=O)O

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

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 9 FractionCSP3: 0.39
AlogP: -0.21 Num_rotatable_bonds: 11
MolWt: 641.63 Num_heavy_atoms: 46
TPSA: 246.36 NumAromaticRings: 3

Unique Aglycone
AD52970
Formula: C25H25O7N3

Smiles:
O=C(C=Cc1ccc(O)c(Cc2cnc[nH]2)c1)N1c2cc(O)c(O)cc2CC1(CCCO)C(=O)O
HBA: 10 RingCount: 4
HBD: 6 FractionCSP3: 0.24
AlogP: 2.32 Num_rotatable_bonds: 8
MolWt: 479.49 Num_heavy_atoms: 35
TPSA: 167.21 NumAromaticRings: 3

Sugarmoiety
SD00003

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