Glycoside
...
GD024679

Name:
None

Formula:
C74H84O24N4

Smiles:
OC[C@@H]1O[C@H](OCCOCCOc2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([nH]5)c(-c5ccc(OCCOCCO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)cc5)c5ccc([nH]5)c(-c5ccc(OCCOCCO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)cc5)c5nc3C=C5)C=C4)cc2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
OCCOCCOc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccc(OCCOCCO)cc4)c4ccc([nH]4)c(-c4ccc(OCCOCCO)cc4)c4nc2C=C4)C=C3)cc1

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

Other Identifiers

Properties
HBA: 28 RingCount: 12
HBD: 14 FractionCSP3: 0.41
AlogP: 2.96 Num_rotatable_bonds: 31
MolWt: 1413.49 Num_heavy_atoms: 102
TPSA: 410.88 NumAromaticRings: 7

Unique Aglycone
AD16449
Formula: C56H54O9N4

Smiles:
OCCOCCOc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccc(OCCOCCO)cc4)c4ccc([nH]4)c(-c4ccc(OCCOCCO)cc4)c4nc2C=C4)C=C3)cc1
HBA: 13 RingCount: 9
HBD: 5 FractionCSP3: 0.21
AlogP: 9.49 Num_rotatable_bonds: 22
MolWt: 927.07 Num_heavy_atoms: 69
TPSA: 173.43 NumAromaticRings: 7

Sugarmoiety
SD00130

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