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CHEBI:156130 - 1alpha,25-dihydroxy-26,27-ethanocholecalciferol

ChEBI IDCHEBI:156130
ChEBI Name1alpha,25-dihydroxy-26,27-ethanocholecalciferol
Stars
Submittermwilliams
DownloadsMolfile
FormulaC29H46O3
Net Charge0
Average Mass442.684
Monoisotopic Mass442.34470
SMILES[H][C@]1([C@]([H])(C)CCCC2(O)CCCC2)CC[C@@]2([H])/C(=C/C=C3/C[C@@H](O)C[C@H](O)C3=C)CCC[C@]12C
InChIInChI=1S/C29H46O3/c1-20(8-6-17-29(32)15-4-5-16-29)25-12-13-26-22(9-7-14-28(25,26)3)10-11-23-18-24(30)19-27(31)21(23)2/h10-11,20,24-27,30-32H,2,4-9,12-19H2,1,3H3/b22-10+,23-11-/t20-,24-,25-,26+,27+,28-/m1/s1
InChIKeyRYXPWQZXOPPLEF-OXZNTLLFSA-N
Roles Classification
Biological Role:
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
ChEBI Ontology
Outgoing Relation(s)
1alpha,25-dihydroxy-26,27-ethanocholecalciferol (CHEBI:156130) is a vitamin D (CHEBI:27300)
Synonyms  Source
1alpha,25-dihydroxy-26,27-ethanovitamin D3SUBMITTER
(5Z,7E)-(1S,3R)-26,27-ethano-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triolSUBMITTER
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