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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 > 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3
... > 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 > 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3

Preferred term

20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin d3  

Type

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

Broader concept

charge

  • 0

formula

  • C28H46O3

inchi

  • InChI=1S/C28H46O3/c1-20-22(18-24(29)19-26(20)30)13-12-21-14-15-23(28(4)17-9-11-25(21)28)10-7-5-6-8-16-27(2,3)31/h12-13,23-26,29-31H,1,5-11,14-19H2,2-4H3/b21-12+,22-13-/t23-,24-,25+,26+,28+/m1/s1

inchikey

  • QYYKGLLHBFTBFY-DDWZFWDPSA-N

mass

  • 430.673

monoisotopicmass

  • 430.34470

smiles

  • O[C@@H]1C/C(=C/C=C/2/[C@]3([C@]([C@@H](CC2)CCCCCCC(O)(C)C)(CCC3)C)[H])/C([C@@H](O)C1)=C

subset

  • 2_STAR

synonym EXACT

  • (1R,3S,5Z)-5-[(2E)-2-[(3aS,7R,7aS)-7-(7-hydroxy-7-methyloctyl)-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:190314

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