GD002416

Name:

None

Formula:

C56H92O33N5P

Smiles:

C=CC(C)(CCC=C(C)CCC=C(C)C)C(O)CO[C@H](COP(=O)(O)O[C@@H]1O[C@H](C(N)=O)[C@@](C)(O)[C@H](OC(N)=O)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O[C@@H]2O[C@H](C)[C@H](O[C@@H]3O[C@H](C(N)=O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1NC(C)=O)C(=O)O

Aglycone:

C=CC(C)(CCC=C(C)CCC=C(C)C)C(O)COC(COP(=O)(O)O)C(=O)O

Sugarmoiety:

CC(=O)NC1C(OC2C(COC3OC(CO)C(O)C(O)C3O)OC(OC3C(O)OC(C(N)=O)C(C)(O)C3OC(N)=O)C(NC(C)=O)C2O)OC(C)C(OC2OC(C(N)=O)C(O)C(O)C2O)C1O

Other Identifiers

• CHEMBL3215518

AD02313

Formula: C20H35O8P

Smiles:

C=CC(C)(CCC=C(C)CCC=C(C)C)C(O)COC(COP(=O)(O)O)C(=O)O

HBA:	8	RingCount:	0
HBD:	4	FractionCSP3:	0.65
AlogP:	3.59	Num_rotatable_bonds:	15
MolWt:	434.47	Num_heavy_atoms:	29
TPSA:	133.52	NumAromaticRings:	0