skip to main content

Content language

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

Concept information

Preferred term

icas#19  

Type

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

charge

  • 0

formula

  • C27H37NO7

has_functional_parent

  • CHEBI:78957
  • CHEBI:78977

inchi

  • InChI=1S/C27H37NO7/c1-18(12-8-6-4-3-5-7-9-15-25(30)31)33-27-23(29)16-24(19(2)34-27)35-26(32)21-17-28-22-14-11-10-13-20(21)22/h9-11,13-15,17-19,23-24,27-29H,3-8,12,16H2,1-2H3,(H,30,31)/b15-9+/t18-,19+,23-,24-,27-/m1/s1

inchikey

  • CQSBSCBIGYDANS-OQGVURBQSA-N

mass

  • 487.58520

monoisotopicmass

  • 487.25700

smiles

  • C[C@H](CCCCCCC/C=C/C(O)=O)O[C@@H]1O[C@@H](C)[C@@H](C[C@H]1O)OC(=O)c1c[nH]c2ccccc12

subset

  • 3_STAR

synonym EXACT

  • (2E,11R)-11-{[3,6-dideoxy-4-O-(1H-indol-3-ylcarbonyl)-alpha-L-arabino-hexopyranosyl]oxy}dodec-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79106

Download this concept: