GD106534

Name:

None

Formula:

C22H27O11N3

Smiles:

COc1nc2c(ccn2[C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)n1C

Aglycone:

COC(C)=O.COc1nc2c(c(=O)n1C)C=C[N]2

Sugarmoiety:

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

Other Identifiers

• ZINC000005810403

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

AD40350

Formula: C8H8O2N3

Smiles:

COc1nc2c(c(=O)n1C)C=C[N]2

HBA:	5	RingCount:	2
HBD:	0	FractionCSP3:	0.25
AlogP:	0.01	Num_rotatable_bonds:	1
MolWt:	178.17	Num_heavy_atoms:	13
TPSA:	58.22	NumAromaticRings:	1