TPCN00552

Name Illigerate C;Illigerate A
Molecular Formula C19H24O4
Molecular Weight 316.40
CAS Registry Number 2083679-28-9
SMILES CC1=CC(OC(=O)CCc2ccccc2)C(C(C)(C)O)CC1=O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Hernandiaceae Illigera aromatica Stems 0.000141% Nat Prod Res, 2019, 1-7. 10.1080/14786419.2019.1614574
Hernandiaceae Illigera aromatica Stems 0.000078% Nat Prod Res, 2019, 1-7. 10.1080/14786419.2019.1614574
Properties
HBA 4 HBD 1
HeavyAtoms 23 AlogP 2.84
TPSA 63.60 RotatableBonds 5
FractionCSP3 0.47 Rings 2
AromaticRings 1 AliphaticRings 1