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

Preferred term

scabronine e  

Type

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

Broader concept

charge

  • 0

formula

  • C22H28O5

inchi

  • InChI=1S/C22H28O5/c1-13(2)16-7-8-22(20(25)26)10-9-21(4)17(19(16)22)6-5-15(12-23)11-18(21)27-14(3)24/h5-6,12-13,18H,7-11H2,1-4H3,(H,25,26)/t18-,21+,22-/m0/s1

inchikey

  • HOSRLRWNDVYKNJ-BWAGFHJFSA-N

mass

  • 372.461

monoisotopicmass

  • 372.19367

smiles

  • O=C(O)[C@]12C(C3=CC=C(C=O)C[C@@H]([C@]3(C)CC1)OC(=O)C)=C(C(C)C)CC2

subset

  • 2_STAR

synonym EXACT

  • (3aS,5aR,6S)-6-acetyloxy-8-ormyl-5a-methyl-1-propan-2-yl-2,3,4,5,6,7-hexahydrocyclohepta[g]indene-3a-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198589

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