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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 > organic hydroxy compound > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > 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 > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > 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 > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > 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 > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > 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 > seco-steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > (23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol

Preferred term

(23r)-1alpha,23,25-trihydroxy-23-methylvitamin d3 / (23r)-1alpha,23,25-trihydroxy-23-methylcholecalciferol  

Type

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

Broader concept

charge

  • 0

formula

  • C28H46O4

inchi

  • InChI=1S/C28H46O4/c1-18(16-27(5,32)17-26(3,4)31)23-11-12-24-20(8-7-13-28(23,24)6)9-10-21-14-22(29)15-25(30)19(21)2/h9-10,18,22-25,29-32H,2,7-8,11-17H2,1,3-6H3/b20-9+,21-10-/t18-,22-,23-,24+,25+,27-,28-/m1/s1

inchikey

  • IURVMXSCXUBNCV-JRKPWWIESA-N

mass

  • 446.672

monoisotopicmass

  • 446.33961

smiles

  • O[C@](C[C@H]([C@@]1([C@@]2([C@@](CC1)(/C(/CCC2)=C/C=C/3/C[C@@H](O)C[C@H](O)C3=C)[H])C)[H])C)(CC(O)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,4R)-4,6-dihydroxy-4,6-dimethylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:178548

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