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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > valerenolic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > valerenolic acid

Preferred term

valerenolic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O3

inchi

  • InChI=1S/C15H22O3/c1-8-4-5-11(6-10(3)15(17)18)13-9(2)7-12(16)14(8)13/h6,8,11-12,14,16H,4-5,7H2,1-3H3,(H,17,18)/b10-6+

inchikey

  • XJNQXTISSHEQKD-UXBLZVDNSA-N

mass

  • 250.338

monoisotopicmass

  • 250.15689

smiles

  • OC1C2C(CCC(C2=C(C1)C)/C=C(/C)/C(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (E)-3-(1-hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:174304

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