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 > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > monoterpenoid > hapalindole q
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > hapalindole q

Preferred term

hapalindole q  

Type

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

Broader concept

charge

  • 0

formula

  • C21H24N2S

inchi

  • InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20+,21-/m0/s1

inchikey

  • PPHWDUZMWNUINO-NOOVBMIQSA-N

mass

  • 336.500

monoisotopicmass

  • 336.16602

smiles

  • S=C=N[C@H]1[C@@](C=C)(CC[C@H]([C@@H]1C=2C3=C(C=CC=C3)NC2)C(=C)C)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(1R,2R,3R,6R)-3-ethenyl-2-isothiocyanato-3-methyl-6-prop-1-en-2-ylcyclohexyl]-1H-indole

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201745

Download this concept:

RDF/XML TURTLE JSON-LD