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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 > lipid > steroid > cholestanoid > 7-dehydrocholesterol 5,6-oxide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > 7-dehydrocholesterol 5,6-oxide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > 7-dehydrocholesterol 5,6-oxide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholestanoid > 7-dehydrocholesterol 5,6-oxide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholestanoid > 7-dehydrocholesterol 5,6-oxide

Preferred term

7-dehydrocholesterol 5,6-oxide  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44O2

inchi

  • InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h15,17-19,21-24,28H,6-14,16H2,1-5H3/t18-,19+,21-,22+,23+,24-,25-,26-,27-/m1/s1

inchikey

  • HQJPDAPYXZGRSF-RMXJHBPESA-N

mass

  • 400.647

monoisotopicmass

  • 400.33413

smiles

  • O1[C@@]23[C@@]([C@@]4(C([C@]5([C@@]([C@](CC5)([C@@H](CCCC(C)C)C)[H])(CC4)C)[H])=C[C@@]12[H])[H])(CC[C@H](O)C3)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,5S,7S,9R,12R,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-10-en-5-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:192164

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