Glycoside
...
GD139851

Name:
16-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5-dioxa-10-azapentacyclo[9.7.1.0²,⁶.0⁸,¹⁹.0¹³,¹⁸]nonadeca-1(18),2(6),7,11(19),12,14,16-heptaen-9-one

Formula:
C22H19O9N

Smiles:
OCC1OC(Oc2ccc3cc4c5c(cc6c(c5c3c2)OCO6)C(O)=N4)C(O)C(O)C1O

Aglycone:
OC1=Nc2cc3ccc(O)cc3c3c4c(cc1c23)OCO4

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

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 5 FractionCSP3: 0.32
AlogP: 0.85 Num_rotatable_bonds: 3
MolWt: 441.39 Num_heavy_atoms: 32
TPSA: 150.43 NumAromaticRings: 3

Unique Aglycone
AD56401
Formula: C16H9O4N

Smiles:
OC1=Nc2cc3ccc(O)cc3c3c4c(cc1c23)OCO4
HBA: 5 RingCount: 5
HBD: 2 FractionCSP3: 0.06
AlogP: 3.38 Num_rotatable_bonds: 0
MolWt: 279.25 Num_heavy_atoms: 21
TPSA: 71.28 NumAromaticRings: 3

Sugarmoiety
SD00003

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