TPCN02046

Name (E)-Deca-2-ene-4,6-diyne-1,10-diol-1-O-??-D-glucopyranoside
Molecular Formula C16H20O7
Molecular Weight 324.33
CAS Registry Number 1932660-18-8
SMILES OCC=CC#CC#CC=CCOC1OC(CO)C(O)C(O)C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Atractylodes lancea Subterraneous stems 0.000010% J Nat Prod 79(6): 1567-1575.(2016) 10.1021/acs.jnatprod.6b00066
Properties
HBA 7 HBD 5
HeavyAtoms 23 AlogP -2.09
TPSA 119.61 RotatableBonds 5
FractionCSP3 0.50 Rings 1
AromaticRings 0 AliphaticRings 1