skip to main content

Content language

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

Concept information

organooxygen compound > ester > carboxylic ester > methyl ester > 15-o-propionylbruceolide
... > organooxygen compound > ester > carboxylic ester > lactone > delta-lactone > 15-o-propionylbruceolide
organooxygen compound > ester > lactone > delta-lactone > 15-o-propionylbruceolide
organooxygen compound > oxacycle > lactone > delta-lactone > 15-o-propionylbruceolide
organooxygen compound > ether > cyclic ether > 15-o-propionylbruceolide
organooxygen compound > oxacycle > cyclic ether > 15-o-propionylbruceolide

Preferred term

15-o-propionylbruceolide  

Type

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

charge

  • 0

formula

  • C24H30O11

has_functional_parent

inchi

  • InChI=1S/C24H30O11/c1-5-13(26)35-16-18-23-8-33-24(18,21(31)32-4)19(29)15(28)17(23)22(3)7-11(25)14(27)9(2)10(22)6-12(23)34-20(16)30/h10,12,15-19,27-29H,5-8H2,1-4H3/t10-,12+,15+,16+,17+,18+,19-,22-,23+,24+/m0/s1

inchikey

  • JMNCUIIGFZOUJI-URHSRZJXSA-N

mass

  • 494.48840

monoisotopicmass

  • 494.17881

smiles

  • CCC(=O)O[C@@H]1[C@@H]2[C@@]34CO[C@]2([C@@H](O)[C@H](O)[C@@H]3[C@@]2(C)CC(=O)C(O)=C(C)[C@@H]2C[C@H]4OC1=O)C(=O)OC

subset

  • 3_STAR

synonym EXACT

  • methyl (11beta,12alpha,15beta)-3,11,12-trihydroxy-2,16-dioxo-15-(propanoyloxy)-13,20-epoxypicras-3-en-21-oate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65531

Download this concept: