Glycoside
...
GD152283

Name:
None

Formula:
C36H43O10N5

Smiles:
CNCCC1(C)Oc2c(cc3c(=O)cc(C)oc3c2-n2cc3cc[nH]c3c2)CC1OOCC(O)C(O)(Cn1ccc2[nH]ccc21)C(O)C(O)CO

Aglycone:
CNCCC1(C)Oc2c(cc3c(=O)cc(C)oc3c2-n2cc3cc[nH]c3c2)CC1O.Cn1ccc2[nH]ccc21

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

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 8 FractionCSP3: 0.42
AlogP: 1.78 Num_rotatable_bonds: 14
MolWt: 705.77 Num_heavy_atoms: 51
TPSA: 212.52 NumAromaticRings: 6

Unique Aglycone
AD45137
Formula: C7H8N2

Smiles:
Cn1ccc2[nH]ccc21
HBA: 2 RingCount: 2
HBD: 1 FractionCSP3: 0.14
AlogP: 1.51 Num_rotatable_bonds: 0
MolWt: 120.15 Num_heavy_atoms: 9
TPSA: 20.72 NumAromaticRings: 2
AD47300
Formula: C23H25O4N3

Smiles:
CNCCC1(C)Oc2c(cc3c(=O)cc(C)oc3c2-n2cc3cc[nH]c3c2)CC1O
HBA: 7 RingCount: 5
HBD: 3 FractionCSP3: 0.35
AlogP: 3.04 Num_rotatable_bonds: 4
MolWt: 407.47 Num_heavy_atoms: 30
TPSA: 92.42 NumAromaticRings: 4

Sugarmoiety
SD04404

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