GD020803

Name:

None

Formula:

C30H33O10N3S

Smiles:

CC(=O)OCC1OC(NC(=S)NN=C2CC(c3ccccc3)Oc3ccccc32)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:

COC(C)=O.NC(=S)NN=C1CC(c2ccccc2)Oc2ccccc21

Sugarmoiety:

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

Other Identifiers

• CHEMBL1966063

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

AD14306

Formula: C16H15ON3S

Smiles:

NC(=S)NN=C1CC(c2ccccc2)Oc2ccccc21

HBA:	4	RingCount:	3
HBD:	3	FractionCSP3:	0.12
AlogP:	2.75	Num_rotatable_bonds:	2
MolWt:	297.38	Num_heavy_atoms:	21
TPSA:	59.64	NumAromaticRings:	2