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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide
... > organooxygen compound > ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide
... > organooxygen compound > oxacycle > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide

Preferred term

rel-(+)-(1r,10r)-cembra-2e,4e,7e,11z-tetraen-20,10-olide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C20H28O2

has_role

inchi

  • InChI=1S/C20H28O2/c1-14(2)17-9-8-15(3)6-5-7-16(4)12-19-13-18(11-10-17)20(21)22-19/h6-9,13-14,17,19H,5,10-12H2,1-4H3/b9-8+,15-6+,16-7+/t17-,19-/m1/s1

inchikey

  • GFSIRKGSRCAQRP-BSTDZIDZSA-N

mass

  • 300.43510

monoisotopicmass

  • 300.20893

smiles

  • CC(C)[C@H]1CCC2=C[C@@H](C/C(C)=C/C/C=C(C)/C=C/1)OC2=O

subset

  • 3_STAR

synonym EXACT

  • (4R*,5E,7E,10E,13R*)-7,11-dimethyl-4-(propan-2-yl)-14-oxabicyclo[11.2.1]hexadeca-1(16),5,7,10-tetraen-15-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68875

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