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Concept information

Preferred term

arbusculic acid a  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O5

inchi

  • InChI=1S/C20H30O5/c1-12-13(8-11-21)4-5-15-14(12)6-10-20(25)18(15,2)9-7-16(22)19(20,3)17(23)24/h4-5,8,12,14-16,21-22,25H,6-7,9-11H2,1-3H3,(H,23,24)/b13-8+/t12-,14-,15-,16+,18+,19+,20-/m0/s1

inchikey

  • SIYWUVAANMMTCY-RGPAJSELSA-N

mass

  • 350.455

monoisotopicmass

  • 350.20932

smiles

  • O=C(O)[C@@]1([C@@]2(O)[C@@]([C@H]3C=C/C(=C/CO)/[C@@H]([C@@H]3CC2)C)(CC[C@H]1O)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,4aR,4bS,7E,8R,8aS,10aS)-2,10a-dihydroxy-7-(2-hydroxyethylidene)-1,4a,8-trimethyl-2,3,4,4b,8,8a,9,10-octahydrophenanthrene-1-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214627

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