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Concept information

Preferred term

ibho#22  

Type

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

charge

  • 0

formula

  • C28H41NO8

has_functional_parent

  • CHEBI:79261
  • CHEBI:79279

inchi

  • InChI=1S/C28H41NO8/c1-19-25(37-27(34)22-18-29-23-14-10-9-13-21(22)23)17-24(31)28(36-19)35-15-11-7-5-3-2-4-6-8-12-20(30)16-26(32)33/h9-10,13-14,18-20,24-25,28-31H,2-8,11-12,15-17H2,1H3,(H,32,33)/t19-,20+,24+,25+,28+/m0/s1

inchikey

  • FUIIPNLIVZGYJM-RHENGWIESA-N

mass

  • 519.62700

monoisotopicmass

  • 519.28322

smiles

  • C[C@@H]1O[C@@H](OCCCCCCCCCC[C@@H](O)CC(O)=O)[C@H](O)C[C@H]1OC(=O)c1c[nH]c2ccccc12

subset

  • 3_STAR

synonym EXACT

  • (3R)-13-{[3,6-dideoxy-4-O-(1H-indol-3-ylcarbonyl)-alpha-L-arabino-hexopyranosyl]oxy}-3-hydroxytridecanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79374

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