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Concept information

Preferred term

aculeatol e  

Type

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

charge

  • 0

formula

  • C26H44O5

inchi

  • InChI=1S/C26H44O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-23-18-22(28)20-26(30-23)17-16-25(31-26)15-14-21(27)19-24(25)29/h14-15,22-24,28-29H,2-13,16-20H2,1H3/t22-,23-,24+,25+,26+/m1/s1

inchikey

  • UBFNRKJKPNNCHD-JMTTVTNBSA-N

mass

  • 436.62460

monoisotopicmass

  • 436.31887

smiles

  • CCCCCCCCCCCCC[C@@H]1C[C@@H](O)C[C@@]2(CC[C@@]3(O2)C=CC(=O)C[C@@H]3O)O1

subset

  • 3_STAR

synonym EXACT

  • (2R,4R,6S,8R,13S)-4,13-dihydroxy-2-tridecyl-1,7-dioxadispiro[5.1.5.2]pentadec-9-en-11-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65368

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