Glycoside
...
GD028839

Name:
None

Formula:
C26H48O17N2P2

Smiles:
CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OCC[C@H](C)CCC=C(C)C)[C@H](NC(C)=O)[C@H]2O)O[C@H](CO)[C@H](O)[C@H]1O

Aglycone:
CC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)O

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2NC(C)=O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 2
HBD: 9 FractionCSP3: 0.85
AlogP: -1.08 Num_rotatable_bonds: 17
MolWt: 722.62 Num_heavy_atoms: 47
TPSA: 289.33 NumAromaticRings: 0

Unique Aglycone
AD10594
Formula: C10H22O7P2

Smiles:
CC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)O
HBA: 7 RingCount: 0
HBD: 3 FractionCSP3: 0.8
AlogP: 2.99 Num_rotatable_bonds: 9
MolWt: 316.23 Num_heavy_atoms: 19
TPSA: 113.29 NumAromaticRings: 0

Sugarmoiety
SD00093

CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2NC(C)=O)C1O