GD022964

Name:

None

Formula:

C42H75O33N5P2

Smiles:

CC(=O)NCCCC[C@H](NC(=O)[C@H](NC(C)=O)[C@H](C)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@H](O)[C@H]1O)C(=O)N[C@H](C(N)=O)[C@H](C)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC(=O)NCCCCC(NC(=O)C(NC(C)=O)C(C)O)C(=O)NC(C(N)=O)C(C)O.COP(=O)(O)O.COP(=O)(O)O

Sugarmoiety:

OCC1OC(O)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O.OCC1OC(O)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O

Other Identifiers

• CHEMBL1162088

AD00079

Formula: CH5O4P

Smiles:

COP(=O)(O)O

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	1.0
AlogP:	-0.27	Num_rotatable_bonds:	1
MolWt:	112.02	Num_heavy_atoms:	6
TPSA:	66.76	NumAromaticRings:	0

AD15499

Formula: C18H33O7N5

Smiles:

CC(=O)NCCCCC(NC(=O)C(NC(C)=O)C(C)O)C(=O)NC(C(N)=O)C(C)O

HBA:	12	RingCount:	0
HBD:	8	FractionCSP3:	0.72
AlogP:	-2.99	Num_rotatable_bonds:	13
MolWt:	431.49	Num_heavy_atoms:	30
TPSA:	199.95	NumAromaticRings:	0