GD000689

Name:

OLIGOPORIN A

Formula:

C36H54O9

Smiles:

CC(=CCC[C@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@@H]4C(C)(C)C(=O)CC[C@@]4(C)C3=C[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@]12C)C(=O)O

Aglycone:

CC(=CCCC(C)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CC(O)C12C)C(=O)O

Sugarmoiety:

OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL395860
• CNP0103548

AD00743

Formula: C30H44O4

Smiles:

CC(=CCCC(C)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CC(O)C12C)C(=O)O

HBA:	4	RingCount:	4
HBD:	2	FractionCSP3:	0.73
AlogP:	6.5	Num_rotatable_bonds:	5
MolWt:	468.68	Num_heavy_atoms:	34
TPSA:	74.6	NumAromaticRings:	0