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Concept information

Preferred term

ganoderenic acid e  

Type

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

Broader concept

charge

  • 0

formula

  • C30H40O8

inchi

  • InChI=1S/C30H40O8/c1-14(10-16(31)11-15(2)26(37)38)17-12-21(34)30(7)22-18(32)13-19-27(3,4)20(33)8-9-28(19,5)23(22)24(35)25(36)29(17,30)6/h10,15,17-19,25,32,36H,8-9,11-13H2,1-7H3,(H,37,38)/b14-10+/t15-,17?,18-,19?,25+,28-,29-,30-/m0/s1

inchikey

  • UFIFFDILGAASQL-XYZDLWCTSA-N

mass

  • 528.642

monoisotopicmass

  • 528.27232

smiles

  • O[C@H]1[C@]2([C@](C3=C([C@@]4(C(C[C@@H]3O)C(C(=O)CC4)(C)C)C)C1=O)(C(=O)CC2/C(/C)=C/C(=O)C[C@H](C)C(O)=O)C)C

subset

  • 2_STAR

synonym EXACT

  • (E,2S)-6-[(7S,10S,12S,13R,14R)-7,12-dihydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-5-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175949

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