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

Concept information

Preferred term

carneic acid j  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30O3

inchi

  • InChI=1S/C21H30O3/c1-14-7-6-8-17-13-16(3)20(15(2)11-12-22)18(21(14)17)9-4-5-10-19(23)24/h4-5,9-11,13-14,17-18,20-22H,6-8,12H2,1-3H3,(H,23,24)/b9-4+,10-5+,15-11?/t14-,17-,18+,20+,21+/m0/s1

inchikey

  • ZAVTXWWFRUFGIQ-LZGZPVOOSA-N

mass

  • 330.468

monoisotopicmass

  • 330.21949

smiles

  • O=C(O)/C=C/C=C/[C@@H]1[C@@H](C(=C[C@H]2[C@H]1[C@H](CCC2)C)C)C(=CCO)C

subset

  • 2_STAR

synonym EXACT

  • (2E,4E)-5-[(1S,2S,4aR,8S,8aR)-2-(4-hydroxybut-2-en-2-yl)-3,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]penta-2,4-dienoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224407

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