General Information of Natural Product (ID: NP0808)
  Natural Product Name
Zerumbone
  Synonyms
Zerumbone; 471-05-6; (2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one; (E,E,E)-2,6,9,9-Tetramethyl-2,6,10-cycloundecatrien-1-one; CHEMBL245412; 2E,6E,9E-humulatrien-8-one; CHEBI:63892; C15H22O; Zerumbone (6CI,7CI); erumbone; 2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one; SCHEMBL12831266; Zerumbone, >=98% (HPLC); SRCZ-00151; HY-N7015; BDBM50241296; MFCD03700769; NSC698299; s5928; ZINC28878195; CCG-208558; NSC-698299; XZ166948; CS-0003365; C20262; Q27132897
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  Formula C15H22O
  Weight 218.33
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-9,11H,5-6,10H2,1-4H3/b11-9+,12-8+,13-7+
  InChI Key GIHNTRQPEMKFKO-SKTNYSRSSA-N
  Isomeric SMILES C/C/1=C\\CC(/C=C/C(=O)/C(=C/CC1)/C)(C)C
  Canonical SMILES CC1=CCC(C=CC(=O)C(=CCC1)C)(C)C
  External Links PubChem ID 5470187
CAS ID 471-05-6
NPASS ID NPC216921
HIT ID C0490
CHEMBL ID CHEMBL245412
  NP Activity Charts   Click to show/hide

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Hyptis mutabilis
  Factor Name: Developmental Stage Variation [1]
              Species Info Factor Info
               Experiment Detail
It was collected in Lujan, Ayacucho Department, San Luis, Argentina, in the vegetative flowering stage (February 1997) and at flowering-fructification (April 1996).
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               Factor Function
Flowering and flowering-fructification, did not differ in regard to the composition of analyzed sesquiterpenes but showed variation in the relative concentration of one of its constituents. Twenty-four compounds were identified, which represented 93-5% of the oil in the flowering stage and 92.5% of it in the flowering-fructification one. The oil was found to contain beta-caryophyllene (14.3-12.0%), germacrene D (14.7-15.3%), curzerene (11.5-12.7%) and bicyclogermacrene (12.1-14.2%) as major compounds.
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               Factor Part Location NP Content
 
Aerial part: Flowering stage
Aerial parts San Luis, Argentina
NP Content: 1.31 %
 
Aerial part: flowering-fructification stage
Aerial parts San Luis, Argentina
NP Content: 1.01 %
References
1 Essential Oil of Hyptis mutabilis (Rich.) Briq. Grown in San Luis, Argentina