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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 > tetraterpenoid > carotenoid > xanthophyll > (1r,3s,6e)-6-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-18-[(2s,4s)-2,4-dihydroxy-2,6,6-trimethylcyclohexylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-1,5,5-trimethylcyclohexane-1,3-diol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > tetraterpenoid > carotenoid > xanthophyll > (1r,3s,6e)-6-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-18-[(2s,4s)-2,4-dihydroxy-2,6,6-trimethylcyclohexylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-1,5,5-trimethylcyclohexane-1,3-diol

Preferred term

(1r,3s,6e)-6-[(2e,4e,6e,8e,10e,12e,14e,16e,18e)-18-[(2s,4s)-2,4-dihydroxy-2,6,6-trimethylcyclohexylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-1,5,5-trimethylcyclohexane-1,3-diol  

Type

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

Broader concept

charge

  • 0

formula

  • C40H58O4

inchi

  • InChI=1S/C40H58O4/c1-29(17-13-19-31(3)21-23-35-37(5,6)25-33(41)27-39(35,9)43)15-11-12-16-30(2)18-14-20-32(4)22-24-36-38(7,8)26-34(42)28-40(36,10)44/h11-24,33-34,41-44H,25-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,35-23+,36-24+/t33-,34-,39-,40+/m0/s1

inchikey

  • MVDDWUSHVUIKEM-BCRGLMEZSA-N

mass

  • 602.900

monoisotopicmass

  • 602.43351

smiles

  • O[C@]1(/C(/C(C[C@H](O)C1)(C)C)=C/C=C(/C)/C=C/C=C(/C)/C=C/C=C/C(=C/C=C/C(=C/C=C/2/C(C[C@H](O)C[C@@]2(O)C)(C)C)/C)/C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,6E)-6-[(2E,4E,6E,8E,10E,12E,14E,16E,18E)-18-[(2S,4S)-2,4-dihydroxy-2,6,6-trimethylcyclohexylidene]-3,7,12,16-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenylidene]-1,5,5-trimethylcyclohexane-1,3-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181896

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