TPCN04152

Name Salbige A
Molecular Formula C39H58O10
Molecular Weight 686.88
CAS Registry Number 1459722-13-4
SMILES C=C1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)OCCCC)C(O)C(O)C6O)C(C)(C=O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Amaranthaceae Salicornia herbacea Aerial parts 0.000028% Food Chem 151, 101-109 (2014). 10.1016/j.foodchem.2013.11.030
Properties
HBA 10 HBD 4
HeavyAtoms 49 AlogP 5.12
TPSA 159.82 RotatableBonds 8
FractionCSP3 0.82 Rings 6
AromaticRings 0 AliphaticRings 6