Glycoside
...
GD148994

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

Formula:
C36H39O11N

Smiles:
O=C(O)C1C(CC2(c3ccccc3)CCCC2)c2cc(O)c(OC3OC(CO)C(O)C(O)C3O)cc2N1C(=O)C=Cc1ccc(O)cc1

Aglycone:
O=C(O)C1C(CC2(c3ccccc3)CCCC2)c2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 12 RingCount: 6
HBD: 7 FractionCSP3: 0.39
AlogP: 2.78 Num_rotatable_bonds: 9
MolWt: 661.7 Num_heavy_atoms: 48
TPSA: 197.45 NumAromaticRings: 3

Unique Aglycone
AD59588
Formula: C30H29O6N

Smiles:
O=C(O)C1C(CC2(c3ccccc3)CCCC2)c2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)cc1
HBA: 7 RingCount: 5
HBD: 4 FractionCSP3: 0.27
AlogP: 5.3 Num_rotatable_bonds: 6
MolWt: 499.56 Num_heavy_atoms: 37
TPSA: 118.3 NumAromaticRings: 3

Sugarmoiety
SD00003

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