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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 > monoterpenoid > chloriolin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > chloriolin a

Preferred term

chloriolin a  

Type

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

Broader concept

charge

  • 0

formula

  • C14H21ClO3

inchi

  • InChI=1S/C14H21ClO3/c1-13(2)5-8-4-9(7-16)14(3,10(17)6-15)11(8)12(13)18/h4,8,11-12,16,18H,5-7H2,1-3H3/t8-,11-,12+,14+/m0/s1

inchikey

  • QJDLIMFXDMREHY-HDRXNWCYSA-N

mass

  • 272.770

monoisotopicmass

  • 272.11792

smiles

  • ClCC(=O)[C@]1(C(=C[C@@H]2[C@H]1[C@@H](O)C(C)(C)C2)CO)C

subset

  • 2_STAR

synonym EXACT

  • 1-[(1R,3aR,6R,6aR)-6-hydroxy-2-(hydroxymethyl)-1,5,5-trimethyl-3a,4,6,6a-tetrahydropentalen-1-yl]-2-chloroethanone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207900

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