skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide
... > organooxygen compound > ester > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide
... > organooxygen compound > oxacycle > lactone > terpene lactone > diterpene lactone > rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide

Preferred term

rel-(+)-(1r,4s,10r)-4-hydroxycembra-2e,7e,11z-trien-20,10-olide  

Type

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

charge

  • 0

formula

  • C20H30O3

has_role

inchi

  • InChI=1S/C20H30O3/c1-14(2)16-7-8-17-13-18(23-19(17)21)12-15(3)6-5-10-20(4,22)11-9-16/h6,9,11,13-14,16,18,22H,5,7-8,10,12H2,1-4H3/b11-9+,15-6+/t16-,18+,20-/m0/s1

inchikey

  • KLOZYZWTTNSEEN-IBKADNNNSA-N

mass

  • 318.45040

monoisotopicmass

  • 318.21949

smiles

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

subset

  • 3_STAR

synonym EXACT

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

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68867

Download this concept: