CHEBI:137823 - 9,14,19,19,19-pentadeuterio-1α,25-dihydroxyprevitamin D3

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 9,14,19,19,19-pentadeuterio-1α,25-dihydroxyprevitamin D3
ChEBI ID CHEBI:137823
ChEBI ASCII Name 9,14,19,19,19-pentadeuterio-1alpha,25-dihydroxyprevitamin D3
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C27H39D5O3
Net Charge 0
Average Mass 416.637
Monoisotopic Mass 486.40730
InChI InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h9-11,18,22-25,28-30H,6-8,12-17H2,1-5H3/b11-10-/t18-,22-,23-,24+,25+,27-/m1/s1/i2D3,9D,24D
InChIKey DOIZGAFWGREMOD-SGWDTOPTSA-N
SMILES C(=C\C1=C(CC[C@]2([C@]1(CC[C@]2([H])[C@](CCCC(C)(C)O)([H])C)[2H])C)[2H])\C3=C([C@H](C[C@@H](C3)O)O)C([2H])([2H])[2H]
Roles Classification
Biological Role(s): 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.
(via vitamin D )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 9,14,19,19,19-pentadeuterio-1α,25-dihydroxyprevitamin D3 (CHEBI:137823) is a vitamin D (CHEBI:27300)
Synonyms Sources
(6Z)-(1S,3R)-9,14,19,19,19-pentadeuterio-9,10-seco-5(10),6,8-cholestatriene-1,3,25-triol LIPID MAPS
9,14,19,19,19-pentadeuterio-1alpha,25-dihydroxyprecholecalciferol LIPID MAPS
Manual Xref Database
LMST03020097 LIPID MAPS
View more database links
Last Modified
12 July 2017