TPCN04137

Name Salbige B
Molecular Formula C39H60O9
Molecular Weight 672.90
CAS Registry Number 1459722-14-5
SMILES C=C1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)OCCCC)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Amaranthaceae Salicornia herbacea Aerial parts 0.000039% Food Chem 151, 101-109 (2014). 10.1016/j.foodchem.2013.11.030
Properties
HBA 9 HBD 4
HeavyAtoms 48 AlogP 5.94
TPSA 142.75 RotatableBonds 7
FractionCSP3 0.85 Rings 6
AromaticRings 0 AliphaticRings 6