GD106838

Name:

None

Formula:

C24H28O12N2

Smiles:

CC(=O)N[C@@H]1[C@H](OC(=O)CCn2c(=O)oc3ccccc32)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COC(C)=O.O=C(O)CCn1c(=O)oc2ccccc21

Sugarmoiety:

CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• ZINC000245225752

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

AD44228

Formula: C10H9O4N

Smiles:

O=C(O)CCn1c(=O)oc2ccccc21

HBA:	5	RingCount:	2
HBD:	1	FractionCSP3:	0.2
AlogP:	1.07	Num_rotatable_bonds:	3
MolWt:	207.19	Num_heavy_atoms:	15
TPSA:	72.44	NumAromaticRings:	2