GD020578

Name:

None

Formula:

C75H139O19N2P

Smiles:

CCCCCCCCCCC[C@@H](CC(=O)N[C@@H]1C(OC(=O)C[C@H](CCCCCCCCCCC)OC(=O)CCCCCCC)[C@@H](OP(=O)(O)O)C(CO)O[C@H]1OCC(NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCC)C(=O)O)OC(=O)CCCCCCC

Aglycone:

CCCCCCCCCCCC(CC(=O)NC(CO)C(=O)O)OC(=O)CCCCCCC.CCCCCCCCCCCC(CC(=O)O)OC(=O)CCCCCCC.CCCCCCCCCCCC(CC(N)=O)OC(=O)CCCCCCC.O=P(O)(O)O

Sugarmoiety:

OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL427800

AD00019

Formula: H3O4P

Smiles:

O=P(O)(O)O

HBA:	4	RingCount:	0
HBD:	3	FractionCSP3:	0.0
AlogP:	-0.93	Num_rotatable_bonds:	0
MolWt:	97.99	Num_heavy_atoms:	5
TPSA:	77.76	NumAromaticRings:	0

AD02321

Formula: C22H42O4

Smiles:

CCCCCCCCCCCC(CC(=O)O)OC(=O)CCCCCCC

HBA:	4	RingCount:	0
HBD:	1	FractionCSP3:	0.91
AlogP:	6.65	Num_rotatable_bonds:	19
MolWt:	370.57	Num_heavy_atoms:	26
TPSA:	63.6	NumAromaticRings:	0

AD02322

Formula: C22H43O3N

Smiles:

CCCCCCCCCCCC(CC(N)=O)OC(=O)CCCCCCC

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	0.91
AlogP:	6.06	Num_rotatable_bonds:	19
MolWt:	369.59	Num_heavy_atoms:	26
TPSA:	69.39	NumAromaticRings:	0

AD14193

Formula: C25H47O6N

Smiles:

CCCCCCCCCCCC(CC(=O)NC(CO)C(=O)O)OC(=O)CCCCCCC

HBA:	7	RingCount:	0
HBD:	3	FractionCSP3:	0.88
AlogP:	5.13	Num_rotatable_bonds:	22
MolWt:	457.65	Num_heavy_atoms:	32
TPSA:	112.93	NumAromaticRings:	0