TPCN01365

Name 4-O-Acetyl-3-O-(3'-acetoxy-2'-hydroxy-2'-methylbutyryl)cuauhtemone
Molecular Formula C24H36O8
Molecular Weight 452.54
CAS Registry Number 1499777-54-6
SMILES CC(=O)OC(C)C(C)(O)C(=O)OC1CCC2(C)CC(=O)C(=C(C)C)CC2C1(C)OC(C)=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Laggera alata Whole plants 0.000622% Phytochemistry 96: 201-207.(2013) 10.1016/j.phytochem.2013.07.014
Properties
HBA 8 HBD 1
HeavyAtoms 32 AlogP 3.04
TPSA 116.20 RotatableBonds 5
FractionCSP3 0.75 Rings 2
AromaticRings 0 AliphaticRings 2