GD034593

Name:

None

Formula:

C61H99O23N11

Smiles:

CC(=O)N[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](C)[C@H](NC(=O)[C@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C)C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C

Aglycone:

CC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(NC(=O)C(N)Cc1ccc(O)cc1)C(C)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O

Sugarmoiety:

CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O

Other Identifiers

• CHEMBL500997

AD21975

Formula: C47H76O13N10

Smiles:

CC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(NC(=O)C(N)Cc1ccc(O)cc1)C(C)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O

HBA:	23	RingCount:	2
HBD:	13	FractionCSP3:	0.66
AlogP:	-1.72	Num_rotatable_bonds:	25
MolWt:	989.18	Num_heavy_atoms:	70
TPSA:	356.89	NumAromaticRings:	1