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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 > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > 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 > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > 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 > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > hydroxy steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > 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 > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > 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 > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > seco-steroid > hydroxy seco-steroid > vitamin d > 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol

Preferred term

1alpha,25-dihydroxy-(26,26)-(27,27)-diethanovitamin d3 / 1alpha,25-dihydroxy-(26,26)-(27,27)-diethanocholecalciferol  

Type

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

Broader concept

charge

  • 0

formula

  • C31H48O3

inchi

  • InChI=1S/C31H48O3/c1-20(6-4-17-31(34,24-10-11-24)25-12-13-25)27-14-15-28-22(7-5-16-30(27,28)3)8-9-23-18-26(32)19-29(33)21(23)2/h8-9,20,24-29,32-34H,2,4-7,10-19H2,1,3H3/b22-8+,23-9-/t20-,26-,27-,28+,29+,30-/m1/s1

inchikey

  • XLOOAPQXGQUZDQ-FLOOHNOFSA-N

mass

  • 468.722

monoisotopicmass

  • 468.36035

smiles

  • OC(C1CC1)(C2CC2)CCC[C@H]([C@@]3([C@@]4([C@@](CC3)(/C(/CCC4)=C/C=C/5/C[C@@H](O)C[C@H](O)C5=C)[H])C)[H])C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6,6-dicyclopropyl-6-hydroxyhexan-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:169498

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