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Concept information

Preferred term

4a کربوکسی 4ب متیل 5a کلستا 8،24 دین 3b ol  

Type

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

Broader concept

charge

  • 0

formula

  • C29H46O3

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-YCIQJMEESA-N

mass

  • 442.684

monoisotopicmass

  • 442.34470

smiles

  • O[C@@H]1[C@@]([C@]2([C@@](C3=C(C4[C@@](C(CC4)[C@@H](CCC=C(C)C)C)(CC3)C)CC2)(CC1)C)[H])(C)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • (3S,4S,5R,10S,13R)-3-hydroxy-4,10,13-trimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-4-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168659

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