GD018460

Name:

None

Formula:

C42H61O17N5S2

Smiles:

NC(=O)[C@H](CCCCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCS[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCS[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS

Sugarmoiety:

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

Other Identifiers

• CHEMBL1774850

AD13021

Formula: C30H41O7N5S2

Smiles:

NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS

HBA:	12	RingCount:	2
HBD:	8	FractionCSP3:	0.43
AlogP:	0.75	Num_rotatable_bonds:	19
MolWt:	647.82	Num_heavy_atoms:	44
TPSA:	199.95	NumAromaticRings:	2