Glycoside
...
GD144564

Name:
None

Formula:
C40H61O14N5

Smiles:
CNCOC1C(OC2OC=C(C(=O)OC3CCCC3)C(C=CC3=C[NH+](CCO)C=C(C(=O)O)C3=N[C](N)NCCCO)C2C=C2CCCCC2)OC(CO)C(O)C1(O)O

Aglycone:
NC(N=C1C(C=CC2C(C(=O)OC3CCCC3)=COC(O)C2C=C2CCCCC2)=C[NH+](CCO)C=C1C(=O)O)NCCCO

Sugarmoiety:
CNCOC1C(O)OC(CO)C(O)C1(O)O

Other Identifiers

Properties
HBA: 19 RingCount: 5
HBD: 12 FractionCSP3: 0.65
AlogP: -1.71 Num_rotatable_bonds: 19
MolWt: 835.95 Num_heavy_atoms: 59
TPSA: 288.78 NumAromaticRings: 0

Unique Aglycone
AD48946
Formula: C32H47O8N4

Smiles:
NC(N=C1C(C=CC2C(C(=O)OC3CCCC3)=COC(O)C2C=C2CCCCC2)=C[NH+](CCO)C=C1C(=O)O)NCCCO
HBA: 12 RingCount: 4
HBD: 8 FractionCSP3: 0.59
AlogP: 0.78 Num_rotatable_bonds: 13
MolWt: 615.75 Num_heavy_atoms: 44
TPSA: 188.37 NumAromaticRings: 0

Sugarmoiety
SD04325

CNCOC1C(O)OC(CO)C(O)C1(O)O