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Concept information

Preferred term

scabronine f  

Type

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

Broader concept

charge

  • 0

formula

  • C20H26O4

inchi

  • InChI=1S/C20H26O4/c1-12(2)14-6-7-20(18(23)24)9-8-19(3)15(17(14)20)5-4-13(11-21)10-16(19)22/h4-5,11-12,16,22H,6-10H2,1-3H3,(H,23,24)/t16-,19+,20-/m0/s1

inchikey

  • ALNWABXUYKIYJF-DBVUQKKJSA-N

mass

  • 330.424

monoisotopicmass

  • 330.18311

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (3aS,5aR,6S)-8-ormyl-6-hydroxy-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:201371

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