GD011395

Name:

ROMURTIDE

Formula:

C43H78O13N6

Smiles:

CCCCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)O[C@H]1[C@H](NC(C)=O)C(O)O[C@@H](CO)[C@H]1O)C(N)=O)C(=O)O

Aglycone:

CCCCCCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)C(=O)O

Sugarmoiety:

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

Other Identifiers

• CHEMBL1908331

AD08716

Formula: C35H65O8N5

Smiles:

CCCCCCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)C(=O)O

HBA:	13	RingCount:	0
HBD:	8	FractionCSP3:	0.83
AlogP:	3.74	Num_rotatable_bonds:	31
MolWt:	683.93	Num_heavy_atoms:	48
TPSA:	217.02	NumAromaticRings:	0