Glycoside
...
GD027667

Name:
None

Formula:
C35H45O7N5Cl2S

Smiles:
O=C(NCCCCc1cc(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)NCCCCc1cc(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: 0.58
AlogP: 1.94 Num_rotatable_bonds: 15
MolWt: 726.72 Num_heavy_atoms: 48
TPSA: 169.07 NumAromaticRings: 2

Unique Aglycone
AD18153
Formula: C30H35O2N5Cl2S

Smiles:
CNC(=O)NCCCCc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl
HBA: 7 RingCount: 5
HBD: 2 FractionCSP3: 0.5
AlogP: 5.14 Num_rotatable_bonds: 9
MolWt: 576.59 Num_heavy_atoms: 38
TPSA: 67.92 NumAromaticRings: 2

Sugarmoiety
SD00084

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