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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > bile acids > bile acid > 26-glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate

Preferred term

26-glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate  

Type

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

Broader concept

charge

  • 0

formula

  • C34H54O11

inchi

  • InChI=1S/C34H54O11/c1-15(16(2)31(43)45-32-30(42)29(41)28(40)25(14-35)44-32)10-23(37)17(3)21-8-9-22-20-7-6-18-11-19(36)12-26(39)34(18,5)27(20)24(38)13-33(21,22)4/h6,17,19-30,32,35-42H,7-14H2,1-5H3/b16-15-

inchikey

  • PKYGFGNTTYORCF-NXVVXOECSA-N

mass

  • 638.795

monoisotopicmass

  • 638.36661

smiles

  • OC1C2C(C3C(C(CC3)C(C(O)C/C(/C)=C(/C)/C(OC4OC(C(O)C(O)C4O)CO)=O)C)(C1)C)CC=C5C2(C(O)CC(O)C5)C

subset

  • 2_STAR

synonym EXACT

  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (Z)-5-hydroxy-2,3-dimethyl-6-(1,3,11-trihydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)hept-2-enoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184191

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