skip to main content

Content language

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

Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > flavanones > (s)-(e)-2'-(3,6-dimethyl-2-heptenyl)-3',4',7-trihydroxyflavanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > flavanones > (s)-(e)-2'-(3,6-dimethyl-2-heptenyl)-3',4',7-trihydroxyflavanone
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavans > flavanones > (s)-(e)-2'-(3,6-dimethyl-2-heptenyl)-3',4',7-trihydroxyflavanone

Preferred term

(s)-(e)-2'-(3,6-dimethyl-2-heptenyl)-3',4',7-trihydroxyflavanone  

Type

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

Broader concept

charge

  • 0

formula

  • C24H28O5

inchi

  • InChI=1S/C24H28O5/c1-14(2)4-5-15(3)6-8-18-17(10-11-20(26)24(18)28)23-13-21(27)19-9-7-16(25)12-22(19)29-23/h6-7,9-12,14,23,25-26,28H,4-5,8,13H2,1-3H3/b15-6+

inchikey

  • XCUBCLPUFODHKK-GIDUJCDVSA-N

mass

  • 396.483

monoisotopicmass

  • 396.19367

smiles

  • O1C(C2=C(C/C=C(/CCC(C)C)/C)C(O)=C(O)C=C2)CC(=O)C3=C1C=C(O)C=C3

subset

  • 2_STAR

synonym EXACT

  • 2-[2-[(E)-3,6-dimethylhept-2-enyl]-3,4-dihydroxyphenyl]-7-hydroxy-2,3-dihydrochromen-4-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175169

Download this concept: