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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 > diterpenoid > aphidicolin a14
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > aphidicolin a14

Preferred term

aphidicolin a14  

Type

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

Broader concept

charge

  • 0

formula

  • C22H34O6

inchi

  • InChI=1S/C22H34O6/c1-13(23)28-12-22(27)9-8-21-11-15(22)10-14(21)4-5-16-19(21,2)7-6-17(24)20(16,3)18(25)26/h14-17,24,27H,4-12H2,1-3H3,(H,25,26)/t14-,15+,16+,17+,19-,20-,21-,22-/m0/s1

inchikey

  • IENPACSJMLTPMG-TWZWAVKWSA-N

mass

  • 394.508

monoisotopicmass

  • 394.23554

smiles

  • O=C(O)[C@@]1([C@H](O)CC[C@]2([C@H]1CC[C@@H]3[C@@]24CC[C@](O)(COC(=O)C)[C@@H](C4)C3)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,5R,6S,7R,10S,12R,13R)-13-(acetyloxymethyl)-5,13-dihydroxy-2,6-dimethyltetracyclo[10.3.1.01,10.02,7]hexadecane-6-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224722

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