Glycoside
...
GD030132

Name:
None

Formula:
C36H47O7N5Cl2S

Smiles:
O=C(NCCCCCc1cc(Cl)c(CN2CSC[C@H]2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl)NC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO

Aglycone:
CNC(=O)NCCCCCc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl

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

Other Identifiers

Properties
HBA: 12 RingCount: 5
HBD: 7 FractionCSP3: 0.59
AlogP: 2.33 Num_rotatable_bonds: 16
MolWt: 740.75 Num_heavy_atoms: 49
TPSA: 169.07 NumAromaticRings: 2

Unique Aglycone
AD19517
Formula: C31H37O2N5Cl2S

Smiles:
CNC(=O)NCCCCCc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl
HBA: 7 RingCount: 5
HBD: 2 FractionCSP3: 0.52
AlogP: 5.53 Num_rotatable_bonds: 10
MolWt: 590.62 Num_heavy_atoms: 39
TPSA: 67.92 NumAromaticRings: 2

Sugarmoiety
SD00084

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