skip to main content

Chemistry, part 1

Content language

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

Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > stereocalpin a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > stereocalpin a
organooxygen compound > ester > lactone > cyclodepsipeptide > stereocalpin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > stereocalpin a
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > stereocalpin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > stereocalpin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > stereocalpin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > stereocalpin a

Preferred term

stereocalpin a  

Type

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

Broader concept

charge

  • 0

formula

  • C29H36N2O5

inchi

  • InChI=1S/C29H36N2O5/c1-5-12-25-19(2)26(32)20(3)27(33)30-23(17-21-13-8-6-9-14-21)28(34)31(4)24(29(35)36-25)18-22-15-10-7-11-16-22/h6-11,13-16,19-20,23-25H,5,12,17-18H2,1-4H3,(H,30,33)/t19-,20+,23-,24-,25-/m0/s1

inchikey

  • PKKZNSZCFXCHRE-TYCVKICSSA-N

mass

  • 492.616

monoisotopicmass

  • 492.26242

smiles

  • O=C1O[C@H]([C@@H](C(=O)[C@H](C(=O)N[C@H](C(N([C@H]1CC2=CC=CC=C2)C)=O)CC3=CC=CC=C3)C)C)CCC

subset

  • 2_STAR

synonym EXACT

  • (3S,6S,9R,11S,12S)-3,6-dibenzyl-4,9,11-trimethyl-12-propyl-1-oxa-4,7-diazacyclododecane-2,5,8,10-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200195

Download this concept:

RDF/XML TURTLE JSON-LD