GD010095

Name:

None

Formula:

C29H27O14N

Smiles:

CC(=O)OC[C@@H]1OC(OC(C)=O)[C@H](NC(=O)c2cc(O)c3c(c2)C(=O)c2cccc(O)c2C3=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COC(C)=O.NC(=O)c1cc(O)c2c(c1)C(=O)c1cccc(O)c1C2=O

Sugarmoiety:

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O

Other Identifiers

• CHEMBL3121614

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

AD07843

Formula: C15H9O5N

Smiles:

NC(=O)c1cc(O)c2c(c1)C(=O)c1cccc(O)c1C2=O

HBA:	6	RingCount:	3
HBD:	4	FractionCSP3:	0.0
AlogP:	0.97	Num_rotatable_bonds:	1
MolWt:	283.24	Num_heavy_atoms:	21
TPSA:	117.69	NumAromaticRings:	2