skip to main content

Chemistry, part 3

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > (+)-malbrancheamide b(1+)

Preferred term

(+)-malbrancheamide b(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C21H25ClN3O

inchi

  • InChI=1S/C21H24ClN3O/c1-19(2)16-10-21-6-3-7-25(21)11-20(16,24-18(21)26)9-14-13-5-4-12(22)8-15(13)23-17(14)19/h4-5,8,16,23H,3,6-7,9-11H2,1-2H3,(H,24,26)/p+1/t16-,20+,21-/m0/s1

inchikey

  • DXPVAKSJZFQGSS-DQLDELGASA-O

mass

  • 370.900

monoisotopicmass

  • 370.16807

smiles

  • C1=C2C(=CC=C1Cl)C3=C(N2)C([C@]4([C@@]5(C3)C[NH+]6[C@](C4)(CCC6)C(N5)=O)[H])(C)C

subset

  • 2_STAR

synonym RELATED

  • (+)-malbrancheamide B

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:145677

Download this concept:

RDF/XML TURTLE JSON-LD