GD005390

Name:

RHAMNUSTRIOSIDE UNDECAAACETATE

Formula:

C55H62O30

Smiles:

CC(=O)Oc1cc(OC(C)=O)c2c(=O)c(OC(C)=O)c(-c3ccc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5O[C@@H]5O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)cc3)oc2c1

Aglycone:

CC(=O)Oc1cc(OC(C)=O)c2c(=O)c(OC(C)=O)c(-c3ccc(O)cc3)oc2c1

Sugarmoiety:

CC(=O)OC1C(C)OC(OC2C(OCC3OC(O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)OC(C)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CHEMBL444447
• CNP0394020

AD04585

Formula: C21H16O9

Smiles:

CC(=O)Oc1cc(OC(C)=O)c2c(=O)c(OC(C)=O)c(-c3ccc(O)cc3)oc2c1

HBA:	9	RingCount:	3
HBD:	1	FractionCSP3:	0.14
AlogP:	2.94	Num_rotatable_bonds:	4
MolWt:	412.35	Num_heavy_atoms:	30
TPSA:	129.34	NumAromaticRings:	3