GD132890

Name:

Yesanchinoside I

Formula:

C59H100O26

Smiles:

CC(C)=CCCC(C)(OC1OC(COC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1CCC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C

Aglycone:

CC(C)=CCCC(C)(O)C1CCC2(C)C1CCC1C3(C)CCC(O)C(C)(C)C3CCC12C

Sugarmoiety:

OC1COC(OCC2OC(OCC3OC(O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0159179

AD53695

Formula: C30H52O2

Smiles:

CC(C)=CCCC(C)(O)C1CCC2(C)C1CCC1C3(C)CCC(O)C(C)(C)C3CCC12C

HBA:	2	RingCount:	4
HBD:	2	FractionCSP3:	0.93
AlogP:	7.53	Num_rotatable_bonds:	4
MolWt:	444.74	Num_heavy_atoms:	32
TPSA:	40.46	NumAromaticRings:	0