Glycoside
...
GD028953

Name:
None

Formula:
C37H62O11N6

Smiles:
CCCCCCCCCCCCCCCNC(=O)C1=CCN(C)[C@H]([C@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H]2O)[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@H]2O)C(=O)N1C

Aglycone:
CCCCCCCCCCCCCCCNC(=O)C1=CCN(C)C(CO)C(=O)N1C.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:
NCC1OC(OOC2OC(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 8 FractionCSP3: 0.78
AlogP: -0.19 Num_rotatable_bonds: 21
MolWt: 766.93 Num_heavy_atoms: 54
TPSA: 242.14 NumAromaticRings: 1

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD18873
Formula: C24H45O3N3

Smiles:
CCCCCCCCCCCCCCCNC(=O)C1=CCN(C)C(CO)C(=O)N1C
HBA: 6 RingCount: 1
HBD: 2 FractionCSP3: 0.83
AlogP: 3.84 Num_rotatable_bonds: 16
MolWt: 423.64 Num_heavy_atoms: 30
TPSA: 72.88 NumAromaticRings: 0

Sugarmoiety
SD00045

NCC1OC(OOC2OC(O)C(O)C2O)C(O)C1O