skip to main content

Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > polycyclic heteroarene > benzopyrrole > isoindoles > cytochalasin > cytochalasan alkaloid > 21-o-deacetyl-l-696474

Preferred term

21-o-deacetyl-l-696474  

Type

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

Broader concept

charge

  • 0

formula

  • C28H37NO3

inchi

  • InChI=1S/C28H37NO3/c1-17-9-8-12-22-26(31)20(4)19(3)25-23(16-21-10-6-5-7-11-21)29-27(32)28(22,25)24(30)14-13-18(2)15-17/h5-8,10-14,17-19,22-26,30-31H,4,9,15-16H2,1-3H3,(H,29,32)/b12-8-,14-13-/t17-,18+,19+,22-,23-,24+,25-,26+,28+/m0/s1

inchikey

  • CZWPJPMFISENGB-HKYAKYBVSA-N

mass

  • 435.608

monoisotopicmass

  • 435.27734

smiles

  • O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C=C[C@H](C[C@H](CC=C[C@H]4[C@H](O)C(=C)[C@H]3C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,3Z,5S,7S,9Z,11R,12S,14S,15R,16S)-16-benzyl-2,12-dihydroxy-5,7,14-trimethyl-13-methylidene-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-18-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208625

Download this concept:

RDF/XML TURTLE JSON-LD