GD003632

Name:

AGI-134

Formula:

C70H126O26N3P

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNC(=O)CCCCC(=O)NCCCO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O)OC(=O)CCCCCCCC=CCCCCCCCC

Aglycone:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCC(=O)NCCCO)OC(=O)CCCCCCCC=CCCCCCCCC

Sugarmoiety:

CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C1O

Other Identifiers

• CHEMBL4650300

AD03277

Formula: C50H93O11N2P

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCC(=O)NCCCO)OC(=O)CCCCCCCC=CCCCCCCCC

HBA:	13	RingCount:	0
HBD:	4	FractionCSP3:	0.84
AlogP:	11.83	Num_rotatable_bonds:	48
MolWt:	929.27	Num_heavy_atoms:	64
TPSA:	186.79	NumAromaticRings:	0