Glycoside
...
GD031770

Name:
None

Formula:
C61H102O17N2P2

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(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(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)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(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: 0.67
AlogP: 10.93 Num_rotatable_bonds: 37
MolWt: 1197.43 Num_heavy_atoms: 82
TPSA: 289.33 NumAromaticRings: 0

Unique Aglycone
AD18315
Formula: C45H76O7P2

Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O
HBA: 7 RingCount: 0
HBD: 3 FractionCSP3: 0.6
AlogP: 14.99 Num_rotatable_bonds: 29
MolWt: 791.04 Num_heavy_atoms: 54
TPSA: 113.29 NumAromaticRings: 0

Sugarmoiety
SD00093

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