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Chemistry, part 2

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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 > (+)-hirusten-12-oic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > (+)-hirusten-12-oic acid

Preferred term

(+)-hirusten-12-oic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O5

inchi

  • InChI=1S/C15H20O5/c1-7-10(16)11-15(19-11)5-8-4-13(2,20-12(17)18)6-9(8)14(7,15)3/h8-11,16H,1,4-6H2,2-3H3,(H,17,18)/t8-,9-,10-,11-,13+,14+,15-/m1/s1

inchikey

  • LCFUOWBIHPHLEN-BLYYJXBTSA-N

mass

  • 280.320

monoisotopicmass

  • 280.13107

smiles

  • O1[C@]23[C@]([C@]4([C@@](C2)(C[C@](OC(O)=O)(C4)C)[H])[H])(C([C@@H](O)[C@@]13[H])=C)C

subset

  • 2_STAR

synonym EXACT

  • [(1S,3R,5S,7R,8R,10R,11R)-10-hydroxy-5,8-dimethyl-9-methylidene-12-oxatetracyclo[6.4.0.01,11.03,7]dodecan-5-yl] hydrogen carbonate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:179837

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