GD015293

Name:

None

Formula:

C24H35O13N

Smiles:

COC(=O)CC=C[C@H](C)[C@H](C=NO[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)OC

Aglycone:

COC(=O)CC=CC(C)C(C=NO)OC.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CHEMBL1472837

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

AD11131

Formula: C10H17O4N

Smiles:

COC(=O)CC=CC(C)C(C=NO)OC

HBA:	5	RingCount:	0
HBD:	1	FractionCSP3:	0.6
AlogP:	1.22	Num_rotatable_bonds:	6
MolWt:	215.25	Num_heavy_atoms:	15
TPSA:	68.12	NumAromaticRings:	0