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Concept information

Preferred term

4-carboxy-4-methylzymosterol  

Type

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

charge

  • 0

formula

  • C29H46O3

has_functional_parent

inchi

  • InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-28(5,23(20)14-16-27(21,22)4)17-15-25(30)29(24,6)26(31)32/h8,19,21-22,24-25,30H,7,9-17H2,1-6H3,(H,31,32)/t19-,21-,22+,24-,25+,27-,28-,29?/m1/s1

inchikey

  • MYWAIWDQTCHPTH-CKXAGKIBSA-N

mass

  • 442.67370

monoisotopicmass

  • 442.34470

smiles

  • [H][C@@]1(CC[C@@]2([H])C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C(O)=O)[C@]1([H])CC3)[C@H](C)CCC=C(C)C

subset

  • 3_STAR

synonym EXACT

  • 3beta-hydroxy-4-methyl-5alpha-cholesta-8,24-diene-4-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:63842

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