GD107354

Name:

None

Formula:

C23H29O12N

Smiles:

COC(=O)c1ccc(O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2NC(C)=O)c(OC)c1

Aglycone:

COC(=O)c1ccc(O)c(OC)c1.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC000216303350

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

AD00095

Formula: C9H10O4

Smiles:

COC(=O)c1ccc(O)c(OC)c1

HBA:	4	RingCount:	1
HBD:	1	FractionCSP3:	0.22
AlogP:	1.19	Num_rotatable_bonds:	2
MolWt:	182.17	Num_heavy_atoms:	13
TPSA:	55.76	NumAromaticRings:	1