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Concept information

Preferred term

آفیدیکولین A39  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O5

inchi

  • InChI=1S/C20H30O5/c1-17-6-5-15(22)18(2,16(23)24)14(17)4-3-12-9-13-10-19(12,17)7-8-20(13,25)11-21/h9,13-15,21-22,25H,3-8,10-11H2,1-2H3,(H,23,24)/t13-,14-,15-,17+,18+,19+,20+/m1/s1

inchikey

  • BUHBLMJCWYBYOC-KLEXHFHZSA-N

mass

  • 350.455

monoisotopicmass

  • 350.20932

smiles

  • O=C(O)[C@@]1([C@H](O)CC[C@]2([C@H]1CCC=3[C@@]24CC[C@](O)(CO)[C@@H](C4)C3)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,5R,6S,7R,12S,13R)-5,13-dihydroxy-13-(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.01,10.02,7]hexadec-10-ene-6-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224859

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