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

Concept information

Preferred term

chromolaenide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H28O7

inchi

  • InChI=1S/C22H28O7/c1-12-6-7-17(27-16(5)24)14(3)11-19-20(15(4)22(26)29-19)18(10-12)28-21(25)13(2)8-9-23/h6,8,11,17-20,23H,4,7,9-10H2,1-3,5H3/b12-6+,13-8+,14-11-/t17-,18+,19+,20+/m0/s1

inchikey

  • FOCCASNSHDSZLN-CGZYOCHMSA-N

mass

  • 404.454

monoisotopicmass

  • 404.18350

smiles

  • CC(=O)O[C@H]1C/C=C(C)/C[C@@H](OC(=O)C(/C)=C/CO)[C@@H]2[C@H](OC(=O)C2=C)/C=C1/C

subset

  • 2_STAR

synonym EXACT

  • Chromolaenide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3679

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