skip to main content

Content language

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

Concept information

Preferred term

2-o-(beta-d-galactopyranosyl-(1->6)-beta-d-galactopyranosyl) 2s-hydroxynonanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C21H38O13

inchi

  • InChI=1S/C21H38O13/c1-2-3-4-5-6-7-10(19(29)30)32-21-18(28)16(26)14(24)12(34-21)9-31-20-17(27)15(25)13(23)11(8-22)33-20/h10-18,20-28H,2-9H2,1H3,(H,29,30)/t10-,11?,12?,13-,14-,15-,16-,17?,18?,20+,21+/m0/s1

inchikey

  • MMMJHIANFCEHGC-VKIHGLMJSA-N

mass

  • 498.522

monoisotopicmass

  • 498.23124

smiles

  • O1C([C@H](O)[C@H](O)C(O)[C@@H]1O[C@@H](CCCCCCC)C(O)=O)CO[C@@H]2OC([C@H](O)[C@H](O)C2O)CO

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(2S,4S,5R)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxynonanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168008

Download this concept: