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Showing metabocard for 7a,12a-Dihydroxy-5b-cholestan-3-one (BMDB0006887)
Record Information | ||||||||||||||||
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Version | 1.0 | |||||||||||||||
Creation Date | 2016-09-30 23:27:11 UTC | |||||||||||||||
Update Date | 2020-05-21 16:28:48 UTC | |||||||||||||||
BMDB ID | BMDB0006887 | |||||||||||||||
Secondary Accession Numbers |
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Metabolite Identification | ||||||||||||||||
Common Name | 7a,12a-Dihydroxy-5b-cholestan-3-one | |||||||||||||||
Description | DG(20:1(11Z)/18:3(6Z,9Z,12Z)/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(20:1(11Z)/18:3(6Z,9Z,12Z)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway. | |||||||||||||||
Structure | ||||||||||||||||
Synonyms |
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Chemical Formula | C27H46O3 | |||||||||||||||
Average Molecular Weight | 418.6523 | |||||||||||||||
Monoisotopic Molecular Weight | 418.344695338 | |||||||||||||||
IUPAC Name | Not Available | |||||||||||||||
Traditional Name | Not Available | |||||||||||||||
CAS Registry Number | Not Available | |||||||||||||||
SMILES | Not Available | |||||||||||||||
InChI Identifier | InChI=1S/C27H46O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-18,20-25,29-30H,6-15H2,1-5H3/t17?,18?,20?,21-,22+,23-,24-,25?,26+,27-/m1/s1 | |||||||||||||||
InChI Key | HHVQPBXBALLUDF-JEUKKHAPSA-N | |||||||||||||||
Chemical Taxonomy | ||||||||||||||||
Description | belongs to the class of organic compounds known as 1,2-diacylglycerols. These are diacylglycerols containing a glycerol acylated at positions 1 and 2. | |||||||||||||||
Kingdom | Organic compounds | |||||||||||||||
Super Class | Lipids and lipid-like molecules | |||||||||||||||
Class | Glycerolipids | |||||||||||||||
Sub Class | Diradylglycerols | |||||||||||||||
Direct Parent | 1,2-diacylglycerols | |||||||||||||||
Alternative Parents | ||||||||||||||||
Substituents |
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Molecular Framework | Aliphatic acyclic compounds | |||||||||||||||
External Descriptors | Not Available | |||||||||||||||
Ontology | ||||||||||||||||
Status | Expected but not Quantified | |||||||||||||||
Origin |
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Biofunction | Not Available | |||||||||||||||
Application | Not Available | |||||||||||||||
Cellular locations |
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Physical Properties | ||||||||||||||||
State | Solid | |||||||||||||||
Experimental Properties |
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Predicted Properties | Not Available | |||||||||||||||
Spectra | ||||||||||||||||
Spectra |
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Biological Properties | ||||||||||||||||
Cellular Locations |
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Biospecimen Locations | Not Available | |||||||||||||||
Pathways | ||||||||||||||||
Normal Concentrations | ||||||||||||||||
Not Available | ||||||||||||||||
Abnormal Concentrations | ||||||||||||||||
Not Available | ||||||||||||||||
External Links | ||||||||||||||||
HMDB ID | Not Available | |||||||||||||||
DrugBank ID | Not Available | |||||||||||||||
Phenol Explorer Compound ID | Not Available | |||||||||||||||
FooDB ID | FDB024587 | |||||||||||||||
KNApSAcK ID | Not Available | |||||||||||||||
Chemspider ID | Not Available | |||||||||||||||
KEGG Compound ID | Not Available | |||||||||||||||
BioCyc ID | Not Available | |||||||||||||||
BiGG ID | Not Available | |||||||||||||||
Wikipedia Link | Not Available | |||||||||||||||
METLIN ID | Not Available | |||||||||||||||
PubChem Compound | Not Available | |||||||||||||||
PDB ID | Not Available | |||||||||||||||
ChEBI ID | Not Available | |||||||||||||||
References | ||||||||||||||||
Synthesis Reference | Not Available | |||||||||||||||
Material Safety Data Sheet (MSDS) | Not Available | |||||||||||||||
General References | Not Available |
Enzymes
- General function:
- Involved in oxidoreductase activity
- Specific function:
- Not Available
- Gene Name:
- Not Available
- Uniprot ID:
- P52898
- Molecular weight:
- 36784.0
Reactions
7a,12a-Dihydroxy-cholestene-3-one + NADPH → 7a,12a-Dihydroxy-5b-cholestan-3-one + NADP | details |
7a,12a-Dihydroxy-5b-cholestan-3-one + NADP → 5-b-Cholestane-3a ,7a ,12a-triol + NADPH | details |