Glycoside
...
GD129790

Name:
None

Formula:
C50H55O13N3

Smiles:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C24CCCCC4)C1)C(OOCC(O)(Cc1ccc(O)c2ccc(O)cc12)C(O)C(O)C(O)CO)C3

Aglycone:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C24CCCCC4)C1)C(O)C3.Cc1ccc(O)c2ccc(O)cc12

Sugarmoiety:
OCC(O)C(O)C(O)C(O)(O)COO

Other Identifiers

Properties
HBA: 16 RingCount: 10
HBD: 9 FractionCSP3: 0.44
AlogP: 5.48 Num_rotatable_bonds: 12
MolWt: 906.0 Num_heavy_atoms: 66
TPSA: 252.82 NumAromaticRings: 6

Unique Aglycone
AD45031
Formula: C11H10O2

Smiles:
Cc1ccc(O)c2ccc(O)cc12
HBA: 2 RingCount: 2
HBD: 2 FractionCSP3: 0.09
AlogP: 2.56 Num_rotatable_bonds: 0
MolWt: 174.2 Num_heavy_atoms: 13
TPSA: 40.46 NumAromaticRings: 2
AD52582
Formula: C33H35O5N3

Smiles:
Cc1cc(=O)c2cc3c(c(-n4cc5cc[nH]c5c4)c2o1)OC1(CC=CC(C2CN=C(O)C24CCCCC4)C1)C(O)C3
HBA: 8 RingCount: 8
HBD: 3 FractionCSP3: 0.45
AlogP: 5.91 Num_rotatable_bonds: 2
MolWt: 553.66 Num_heavy_atoms: 41
TPSA: 112.98 NumAromaticRings: 4

Sugarmoiety
SD04426

OCC(O)C(O)C(O)C(O)(O)COO