skip to main content

Chemistry, part 1

Content language

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

Concept information

organooxygen compound > cryptoporic acid p

Preferred term

cryptoporic acid p  

Type

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

Broader concept

charge

  • 0

formula

  • C24H36O9

has_functional_parent

inchi

  • InChI=1S/C24H36O9/c1-14-7-8-18-23(3,13-33-15(2)25)9-6-10-24(18,4)17(14)12-32-20(21(28)29)16(11-19(26)27)22(30)31-5/h16-18,20H,1,6-13H2,2-5H3,(H,26,27)(H,28,29)/t16-,17+,18+,20-,23+,24-/m1/s1

inchikey

  • PJALVTFZLKENDR-HJESDRQUSA-N

mass

  • 468.543

monoisotopicmass

  • 468.23593

smiles

  • O=C(OC)[C@@H]([C@@H](OC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(COC(=O)C)C)C)C(=O)O)CC(=O)O

subset

  • 2_STAR

synonym EXACT

  • (2R,3R)-2-[[(1S,4aR,5R,8aS)-5-(acetyloxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-3-methoxycarbonylpentanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213602

Download this concept:

RDF/XML TURTLE JSON-LD