GD099312

Name:

None

Formula:

C19H25O10N3

Smiles:

C=C[C@@H](CO)Nc1cn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(=O)[nH]c1=O

Aglycone:

C=CC(CO)Nc1c[nH]c(=O)[nH]c1=O.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

• ZINC001169787258

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD42239

Formula: C8H11O3N3

Smiles:

C=CC(CO)Nc1c[nH]c(=O)[nH]c1=O

HBA:	6	RingCount:	1
HBD:	4	FractionCSP3:	0.25
AlogP:	-0.98	Num_rotatable_bonds:	4
MolWt:	197.19	Num_heavy_atoms:	14
TPSA:	97.98	NumAromaticRings:	1