GD148742

Name:

Helminthosporoside A

Formula:

C39H64O22

Smiles:

C=C(COC1OC(C(CO)OC2OC(C(O)CO)C(O)C2O)C(O)C1O)C1CCC2(C)CC(OC3OC(C(CO)OC4OC(C(O)CO)C(O)C4O)C(O)C3O)CC(C)=C2C1

Aglycone:

C=C(CO)C1CCC2(C)CC(O)CC(C)=C2C1

Sugarmoiety:

OCC(O)C1OC(OC(CO)C2OC(O)C(O)C2O)C(O)C1O.OCC(O)C1OC(OC(CO)C2OC(O)C(O)C2O)C(O)C1O

Other Identifiers

• CNP0085455

AD59512

Formula: C15H24O2

Smiles:

C=C(CO)C1CCC2(C)CC(O)CC(C)=C2C1

HBA:	2	RingCount:	2
HBD:	2	FractionCSP3:	0.73
AlogP:	2.81	Num_rotatable_bonds:	2
MolWt:	236.35	Num_heavy_atoms:	17
TPSA:	40.46	NumAromaticRings:	0