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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 > organic hydroxy compound > alcohol > tertiary alcohol > 24-o-methyl-24-epi-cyclocitrinol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > tertiary alcohol > 24-o-methyl-24-epi-cyclocitrinol

Preferred term

24-o-methyl-24-epi-cyclocitrinol  

Type

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

Broader concept

charge

  • 0

formula

  • C26H38O4

inchi

  • InChI=1S/C26H38O4/c1-16(30-4)9-12-26(3,29)24-8-7-22-21-15-23(28)18-13-17(5-6-19(27)14-18)20(21)10-11-25(22,24)2/h5,9,12,15-16,18-20,22,24,27,29H,6-8,10-11,13-14H2,1-4H3/b12-9+/t16-,18-,19-,20+,22-,24-,25-,26-/m0/s1

inchikey

  • QTHFMXMBXVRQFK-KXNABNAZSA-N

mass

  • 414.586

monoisotopicmass

  • 414.27701

smiles

  • O=C1C=C2[C@H](CC[C@]3([C@H]2CC[C@@H]3[C@@](O)(/C=C/[C@@H](OC)C)C)C)C=4C[C@H]1C[C@@H](O)CC4

subset

  • 2_STAR

synonym EXACT

  • (2R,5S,6S,9R,13S,15S)-15-hydroxy-6-[(E,2S,5S)-2-hydroxy-5-methoxyhex-3-en-2-yl]-5-methyltetracyclo[11.4.1.02,10.05,9]octadeca-1(17),10-dien-12-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210679

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