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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 a21
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > aphidicolin a21

Preferred term

aphidicolin a21  

Type

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

Broader concept

charge

  • 0

formula

  • C22H36O6

inchi

  • InChI=1S/C22H36O6/c1-13(24)28-12-21(27)8-9-22-14(10-15(21)18(22)26)4-5-16-19(2,11-23)17(25)6-7-20(16,22)3/h14-18,23,25-27H,4-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-,21-,22+/m0/s1

inchikey

  • AOQSNCRBXDAQPZ-JOFRPBRLSA-N

mass

  • 396.524

monoisotopicmass

  • 396.25119

smiles

  • O=C(OC[C@]1(O)[C@H]2[C@H](O)[C@@]3([C@@]4([C@H]([C@@]([C@H](O)CC4)(CO)C)CC[C@H]3C2)C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • [(1S,2S,5R,6R,7R,10S,12R,13R,16S)-5,13,16-trihydroxy-6-(hydroxymethyl)-2,6-dimethyl-13-tetracyclo[10.3.1.01,10.02,7]hexadecanyl]methyl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224763

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