GD018292

Name:

None

Formula:

C41H71O22N11

Smiles:

CC(=O)NC1C(OCCCC(=O)N[C@H](CCCCN)C(=O)NCC(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@H](CC(=O)O)C(=O)N[C@H](CO)C(=O)O)O[C@H](CO)[C@H](O[C@@H]2OC(CO)C(O)[C@H](O)[C@H]2O)C1O

Aglycone:

NCCCCC(NC(=O)CCCO)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)O

Sugarmoiety:

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

Other Identifiers

• CHEMBL406075

AD12933

Formula: C27H48O12N10

Smiles:

NCCCCC(NC(=O)CCCO)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)O

HBA:	22	RingCount:	0
HBD:	16	FractionCSP3:	0.67
AlogP:	-6.34	Num_rotatable_bonds:	26
MolWt:	704.74	Num_heavy_atoms:	49
TPSA:	380.08	NumAromaticRings:	0