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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > kalihinol j
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > kalihinol j

Preferred term

kalihinol j  

Type

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

Broader concept

charge

  • 0

formula

  • C22H35ClN2O3S

inchi

  • InChI=1S/C22H35ClN2O3S/c1-19(2)16(23)8-11-22(5,28-19)15-6-9-20(3,25-13-29)14-7-10-21(4,27)18(17(14)15)24-12-26/h12,14-18,27H,6-11H2,1-5H3,(H,24,26)/t14-,15-,16-,17-,18+,20+,21+,22+/m0/s1

inchikey

  • JJCHVOBKBZMVBH-JJAPNAJXSA-N

mass

  • 443.040

monoisotopicmass

  • 442.20569

smiles

  • Cl[C@@H]1C(O[C@]([C@@H]2[C@H]3[C@@H](NC=O)[C@](O)(CC[C@@H]3[C@@](N=C=S)(C)CC2)C)(C)CC1)(C)C

subset

  • 2_STAR

synonym EXACT

  • N-[(1R,2R,4aS,5R,8S,8aS)-8-[(2R,5S)-5-chloro-2,6,6-trimethyloxan-2-yl]-2-hydroxy-5-isothiocyanato-2,5-dimethyl-1,3,4,4a,6,7,8,8a-octahydronaphthalen-1-yl]ormamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207010

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