GD030483

Name:

Cleistetroside 4

Formula:

C42H72O20

Smiles:

CCCCCCCCCCCCO[C@@H]1O[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](OC(C)=O)[C@H](O[C@@H]3O[C@H](C)[C@H](OC(C)=O)[C@H](O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)[C@H]3OC(C)=O)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:

CCCCCCCCCCCCO

Sugarmoiety:

CC(=O)OC1C(C)OC(OC2C(C)OC(O)C(O)C2O)C(O)C1OC1OC(C)C(OC(C)=O)C(OC2OC(C)C(O)C(O)C2O)C1OC(C)=O

Other Identifiers

• CHEMBL2204989
• CNP0166257

AD00833

Formula: C12H26O

Smiles:

CCCCCCCCCCCCO

HBA:	1	RingCount:	0
HBD:	1	FractionCSP3:	1.0
AlogP:	3.9	Num_rotatable_bonds:	10
MolWt:	186.34	Num_heavy_atoms:	13
TPSA:	20.23	NumAromaticRings:	0