GD110351

Name:

None

Formula:

C34H39O14NS

Smiles:

COC(=O)[C@@H]1O[C@H](Oc2cc3c(c(OC)c2OC)-c2ccc(SC)c(=O)cc2[C@@H](NC(C)=O)CC3)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

COc1c(O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1C(NC(C)=O)CC2

Sugarmoiety:

COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• ZINC000077286757

AD02881

Formula: C21H23O5NS

Smiles:

COc1c(O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1C(NC(C)=O)CC2

HBA:	6	RingCount:	3
HBD:	2	FractionCSP3:	0.33
AlogP:	3.28	Num_rotatable_bonds:	4
MolWt:	401.48	Num_heavy_atoms:	28
TPSA:	84.86	NumAromaticRings:	2