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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 > kaurane diterpenoid > 17-hydroxy-ent-kaur-15-en-19-oic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > kaurane diterpenoid > 17-hydroxy-ent-kaur-15-en-19-oic acid

Preferred term

17-hydroxy-ent-kaur-15-en-19-oic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O3

inchi

  • InChI=1S/C20H30O3/c1-18-7-3-8-19(2,17(22)23)15(18)6-9-20-10-13(4-5-16(18)20)14(11-20)12-21/h11,13,15-16,21H,3-10,12H2,1-2H3,(H,22,23)/t13-,15-,16-,18+,19+,20-/m0/s1

inchikey

  • XEQHVCXFKPCQNM-LEUKZYDJSA-N

mass

  • 318.457

monoisotopicmass

  • 318.21949

smiles

  • OC(=O)[C@]1([C@@]2([C@]([C@]3([C@@]4(CC2)C[C@](CC3)(C(=C4)CO)[H])[H])(CCC1)C)[H])C

subset

  • 2_STAR

synonym EXACT

  • (1S,4S,5R,9S,10S,13S)-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadec-14-ene-5-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190583

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