Glycoside
...
GD016137

Name:
None

Formula:
C30H56O8N2

Smiles:
CCCCCCCCCCCCCCC(=O)N[C@H](C(=O)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(=O)CCC)C(C)C

Aglycone:
CCCC(N)=O.CCCCCCCCCCCCCCC(=O)NC(C(=O)O)C(C)C

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

Other Identifiers

Properties
HBA: 10 RingCount: 1
HBD: 5 FractionCSP3: 0.9
AlogP: 3.49 Num_rotatable_bonds: 21
MolWt: 572.78 Num_heavy_atoms: 40
TPSA: 154.42 NumAromaticRings: 0

Unique Aglycone
AD04242
Formula: C4H9ON

Smiles:
CCCC(N)=O
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.75
AlogP: 0.27 Num_rotatable_bonds: 2
MolWt: 87.12 Num_heavy_atoms: 6
TPSA: 43.09 NumAromaticRings: 0
AD11656
Formula: C20H39O3N

Smiles:
CCCCCCCCCCCCCCC(=O)NC(C(=O)O)C(C)C
HBA: 4 RingCount: 0
HBD: 2 FractionCSP3: 0.9
AlogP: 5.3 Num_rotatable_bonds: 16
MolWt: 341.54 Num_heavy_atoms: 24
TPSA: 66.4 NumAromaticRings: 0

Sugarmoiety
SD00003

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