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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

3-keto petromyzonol  

Type

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

Broader concept

charge

  • 0

formula

  • C24H40O4

inchi

  • InChI=1S/C24H40O4/c1-14(5-4-10-25)17-6-7-18-22-19(13-21(28)24(17,18)3)23(2)9-8-16(26)11-15(23)12-20(22)27/h14-15,17-22,25,27-28H,4-13H2,1-3H3/t14?,15?,17?,18?,19?,20?,21?,22-,23-,24+/m0/s1

inchikey

  • WKLORKLFLMTHHY-RJQVRNMUSA-N

mass

  • 392.580

monoisotopicmass

  • 392.29266

smiles

  • OC1[C@]2(C([C@]3(C([C@@]4(C(CC3O)CC(=O)CC4)C)C1)[H])CCC2C(CCCO)C)C

subset

  • 2_STAR

synonym EXACT

  • (8R,10S,13R)-7,12-dihydroxy-17-(5-hydroxypentan-2-yl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173171

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