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Chemistry, part 2

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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 > aurochrome
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > tetraterpenoid > aurochrome

Preferred term

aurochrome  

Type

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

Broader concept

charge

  • 0

formula

  • C40H56O2

inchi

  • InChI=1S/C40H56O2/c1-29(19-13-21-31(3)33-27-35-37(5,6)23-15-25-39(35,9)41-33)17-11-12-18-30(2)20-14-22-32(4)34-28-36-38(7,8)24-16-26-40(36,10)42-34/h11-14,17-22,27-28,33-34H,15-16,23-26H2,1-10H3/b12-11-,19-13-,20-14+,29-17+,30-18+,31-21-,32-22-

inchikey

  • JLFOTJPFBATTLK-KBGQBOCOSA-N

mass

  • 568.886

monoisotopicmass

  • 568.42803

smiles

  • O1C2(C(C(CCC2)(C)C)=CC1/C(/C)=C/C=C/C(/C)=C/C=C/C=C(/C=C/C=C(/C3OC4(C(C(CCC4)(C)C)=C3)C)/C)/C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[(2Z,4Z,6E,8Z,10E,12E,14Z)-15-(4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzouran-2-yl)-6,11-dimethylhexadeca-2,4,6,8,10,12,14-heptaen-2-yl]-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzouran

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176091

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