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Concept information

Preferred term

(3beta,5beta,8beta,22e,24xi)-ergosta-6,22-diene-3,5,8-triol  

Type

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

Broader concept

charge

  • 0

formula

  • C28H46O3

inchi

  • InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+

inchikey

  • UPJVQRZPXLZUET-BQYQJAHWSA-N

mass

  • 430.673

monoisotopicmass

  • 430.34470

smiles

  • OC12C3C(C(CC3)C(C)/C=C/C(C(C)C)C)(CCC1C4(C(O)(C=C2)CC(O)CC4)C)C

subset

  • 2_STAR

synonym EXACT

  • 17-[(E)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,5,8-triol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168427

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