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Concept information

Preferred term

16 O desmethylasporyergosterol  

Type

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

Broader concept

charge

  • 0

formula

  • C28H42O2

inchi

  • InChI=1S/C28H42O2/c1-17(2)18(3)7-8-19(4)26-25(30)16-24-22-10-9-20-15-21(29)11-13-27(20,5)23(22)12-14-28(24,26)6/h7-10,17-18,20-21,23,25,29-30H,11-16H2,1-6H3/b8-7+,26-19-/t18?,20-,21-,23-,25+,27-,28-/m0/s1

inchikey

  • LHISSQSEJOQIGC-NKDYFMNSSA-N

mass

  • 410.642

monoisotopicmass

  • 410.31848

smiles

  • O[C@@H]1C[C@@H]2C=CC3=C4[C@](/C(=C(/C=C/C(C(C)C)C)/C)/[C@@H](C4)O)(C)CC[C@@H]3[C@@]2(C)CC1

subset

  • 2_STAR

synonym EXACT

  • (3S,5R,9R,10S,13S,16R,17E)-17-[(E)-5,6-dimethylhept-3-en-2-ylidene]-10,13-dimethyl-1,2,3,4,5,9,11,12,15,16-decahydrocyclopenta[a]phenanthrene-3,16-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227217

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