GD124975

Name:

None

Formula:

C22H40O10N2

Smiles:

C[NH2+]C(C(=O)OC(COC(C)=O)C(O)C(O)C(COC(C)=O)OC(=O)C([NH2+]C)C(C)C)=C(C)C

Aglycone:

C[NH2+]C(C=O)=C(C)C.C[NH2+]C(C=O)C(C)C

Sugarmoiety:

CC(=O)OCC(OO)C(O)C(O)C(COC(C)=O)OO

Other Identifiers

• CNP0447448

AD50188

Formula: C6H14ON

Smiles:

C[NH2+]C(C=O)C(C)C

HBA:	2	RingCount:	0
HBD:	2	FractionCSP3:	0.83
AlogP:	-0.6	Num_rotatable_bonds:	3
MolWt:	116.18	Num_heavy_atoms:	8
TPSA:	33.68	NumAromaticRings:	0

AD50535

Formula: C6H12ON

Smiles:

C[NH2+]C(C=O)=C(C)C

HBA:	2	RingCount:	0
HBD:	2	FractionCSP3:	0.5
AlogP:	-0.33	Num_rotatable_bonds:	2
MolWt:	114.17	Num_heavy_atoms:	8
TPSA:	33.68	NumAromaticRings:	0