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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > 10-acetyl-trichoderonic-acid
organooxygen compound > ester > lactone > terpene lactone > 10-acetyl-trichoderonic-acid
organooxygen compound > oxacycle > lactone > terpene lactone > 10-acetyl-trichoderonic-acid

Preferred term

10-acetyl-trichoderonic-acid  

Type

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

Broader concept

charge

  • 0

formula

  • C17H24O7

inchi

  • InChI=1S/C17H24O7/c1-9(2)12-4-5-17(8-18,24-10(3)19)14-13(12)6-11(15(20)21)7-23-16(14)22/h6,9,12-14,18H,4-5,7-8H2,1-3H3,(H,20,21)/t12-,13+,14-,17-/m0/s1

inchikey

  • KFGVZDDPPJMMTR-LOUJCGABSA-N

mass

  • 340.372

monoisotopicmass

  • 340.15220

smiles

  • O([C@]1([C@]2([C@@]([C@@H](CC1)C(C)C)(C=C(COC2=O)C(O)=O)[H])[H])CO)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • (5aS,6S,9R,9aR)-9-acetyloxy-9-(hydroxymethyl)-1-oxo-6-propan-2-yl-3,5a,6,7,8,9a-hexahydro-2-benzoxepine-4-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181700

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