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Chemistry, part 3

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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 > maxacalcitol

Preferred term

maxacalcitol  

Type

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

Broader concept

charge

  • 0

formula

  • C26H42O4

inchi

  • InChI=1S/C26H42O4/c1-17-20(15-21(27)16-24(17)28)9-8-19-7-6-12-26(5)22(10-11-23(19)26)18(2)30-14-13-25(3,4)29/h8-9,18,21-24,27-29H,1,6-7,10-16H2,2-5H3/b19-8+,20-9-/t18-,21+,22+,23-,24-,26+/m0/s1

inchikey

  • DTXXSJZBSTYZKE-ZDQKKZTESA-N

mass

  • 418.610

monoisotopicmass

  • 418.30831

smiles

  • C[C@@]12[C@](/C(=C/C=C/3/C(=C)[C@@H](O)C[C@@H](C3)O)/CCC1)(CC[C@@]2([C@@H](OCCC(C)(C)O)C)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • Maxacalcitol

synonym RELATED

  • 22-oxacalcitriol
  • oxarol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31801

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