GD034443

Name:

None

Formula:

C35H48O12N4

Smiles:

CCCCCCCCCCCC(=O)O[C@@H]1[C@H](OC)[C@H]([C@H](O[C@@H]2OC(C(=O)Nc3ccccc3)=C[C@H](O)[C@H]2O)C(N)=O)O[C@H]1n1ccc(=O)[nH]c1=O

Aglycone:

CCCCCCCCCCCC(=O)O.NC(=O)COC1OC(C(=O)Nc2ccccc2)=CC(O)C1O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

COC1C(O)OC(O)C1O

Other Identifiers

• CHEMBL319362

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

AD00188

Formula: C12H24O2

Smiles:

CCCCCCCCCCCC(=O)O

HBA:	2	RingCount:	0
HBD:	1	FractionCSP3:	0.92
AlogP:	3.99	Num_rotatable_bonds:	10
MolWt:	200.32	Num_heavy_atoms:	14
TPSA:	37.3	NumAromaticRings:	0

AD03492

Formula: C14H16O6N2

Smiles:

NC(=O)COC1OC(C(=O)Nc2ccccc2)=CC(O)C1O

HBA:	8	RingCount:	2
HBD:	5	FractionCSP3:	0.29
AlogP:	-0.91	Num_rotatable_bonds:	5
MolWt:	308.29	Num_heavy_atoms:	22
TPSA:	131.11	NumAromaticRings:	1