GD021090

Name:

None

Formula:

C35H46O14N6S

Smiles:

CSCCC[C@H](NC(=O)N[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O

Aglycone:

CSCCCC(NC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NCC(=O)NCC(=O)NC(Cc1ccc(O)cc1)C(=O)O

Sugarmoiety:

O=C(O)C1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2369514

AD14466

Formula: C29H38O8N6S

Smiles:

CSCCCC(NC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NCC(=O)NCC(=O)NC(Cc1ccc(O)cc1)C(=O)O

HBA:	14	RingCount:	2
HBD:	9	FractionCSP3:	0.38
AlogP:	-0.36	Num_rotatable_bonds:	18
MolWt:	630.72	Num_heavy_atoms:	44
TPSA:	229.05	NumAromaticRings:	2