Glycoside
...
GD121250

Name:
5-hydroxy-1-[3-(4-hydroxyphenyl)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:
C27H31O12N

Smiles:
O=C(C=Cc1ccc(O)cc1)N1c2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2CC1(CCCO)C(=O)O

Aglycone:
O=C(C=Cc1ccc(O)cc1)N1c2cc(O)c(O)cc2CC1(CCCO)C(=O)O

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 8 FractionCSP3: 0.41
AlogP: -0.53 Num_rotatable_bonds: 9
MolWt: 561.54 Num_heavy_atoms: 40
TPSA: 217.68 NumAromaticRings: 2

Unique Aglycone
AD48787
Formula: C21H21O7N

Smiles:
O=C(C=Cc1ccc(O)cc1)N1c2cc(O)c(O)cc2CC1(CCCO)C(=O)O
HBA: 8 RingCount: 3
HBD: 5 FractionCSP3: 0.24
AlogP: 2.0 Num_rotatable_bonds: 6
MolWt: 399.4 Num_heavy_atoms: 29
TPSA: 138.53 NumAromaticRings: 2

Sugarmoiety
SD00003

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