1.02020-04-02 17:55:36 UTC2020-04-02 17:55:37 UTCFDB097394Zizyberenalic acidC31H60O5512.8051512.44407503[H]C(O)(COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCInChI=1S/C31H60O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-30(33)35-27-29(32)28-36-31(34)26-24-22-20-18-16-14-12-10-8-6-4-2/h29,32H,3-28H2,1-2H3JADYBWICRJWGBW-UHFFFAOYSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.TriterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsTriterpenoidsAliphatic homopolycyclic compounds18-hydroxysteroids3-carboxy steroidsAldehydesCarboxylic acidsHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesOxosteroids18-hydroxysteroid18-oxosteroid3-carboxy steroidAldehydeAliphatic homopolycyclic compoundCarbonyl groupCarboxylic acidCarboxylic acid derivativeHydrocarbon derivativeHydroxysteroidMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxosteroidSteroidSteroid acidTriterpenoidaverage_mass512.8051mono_mass512.44407503smiles[H]C(O)(COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCformulaC31H60O5inchiInChI=1S/C31H60O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-30(33)35-27-29(32)28-36-31(34)26-24-22-20-18-16-14-12-10-8-6-4-2/h29,32H,3-28H2,1-2H3inchikeyJADYBWICRJWGBW-UHFFFAOYSA-NSpecdb::MsMs240124Specdb::MsMs240125Specdb::MsMs240126Specdb::MsMs242179Specdb::MsMs242180Specdb::MsMs242181JujubeType 1specificZiziphus zizyphus48393Milk (Cow)Type 2specific119.55336.01.2uM