GD036191

Name:

None

Formula:

C30H49O11N3

Smiles:

CC(C)CCCCCCCCCC=CC(=O)N[C@@H]1C(O)O[C@H](C[C@H](O)[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:

CC(C)CCCCCCCCCC=CC(N)=O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

OC(CC1OC(O)C(O)C(O)C1O)C1OC(O)C(O)C1O

Other Identifiers

• CHEMBL4533831

AD00106

Formula: C4H4O2N2

Smiles:

O=c1cc[nH]c(=O)[nH]1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.94	Num_rotatable_bonds:	0
MolWt:	112.09	Num_heavy_atoms:	8
TPSA:	65.72	NumAromaticRings:	1

AD19639

Formula: C15H29ON

Smiles:

CC(C)CCCCCCCCCC=CC(N)=O

HBA:	2	RingCount:	0
HBD:	2	FractionCSP3:	0.8
AlogP:	4.19	Num_rotatable_bonds:	11
MolWt:	239.4	Num_heavy_atoms:	17
TPSA:	43.09	NumAromaticRings:	0