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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 > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol

Preferred term

(24r)-6,19-epidioxy-1,24-dihydroxy-6,19-dihydrovitamin d3 / (24r)-6,19-epidioxy-1,24-di hydroxy-6,19-dihydrocholecalciferol  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44O5

inchi

  • InChI=1S/C27H44O5/c1-16(2)10-19(28)11-17(3)23-7-8-24-18(6-5-9-27(23,24)4)12-26-21-13-20(29)14-25(30)22(21)15-31-32-26/h12,16-17,19-20,23-26,28-30H,5-11,13-15H2,1-4H3/b18-12+/t17-,19-,20-,23-,24+,25+,26?,27-/m1/s1

inchikey

  • DKYWDJRYWSGSCA-HDINTAEKSA-N

mass

  • 448.644

monoisotopicmass

  • 448.31887

smiles

  • O[C@@H](C[C@H]([C@@]1([C@@]2([C@@](CC1)(/C(/CCC2)=C/C3OOCC4=C3C[C@@H](O)C[C@@H]4O)[H])C)[H])C)CC(C)C

subset

  • 2_STAR

synonym EXACT

  • (5S,7R)-1-[(E)-[(1R,3aS,7aR)-1-[(2R,4R)-4-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-1,4,5,6,7,8-hexahydro-2,3-benzodioxine-5,7-diol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183032

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