CHEBI:143573 - 4β-formyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4β-formyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol
ChEBI ID CHEBI:143573
ChEBI ASCII Name 4beta-formyl-4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol
Definition A 3β-hydroxy-4β-formyl-4α-methylsteroid resulting from the formal oxidation of the 4beta-hydroxymethyl group of 4β-hydroxymethyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol to the corresponding formyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C29H46O2
Net Charge 0
Average Mass 426.685
Monoisotopic Mass 426.34978
InChI InChI=1S/C29H46O2/c1-19(2)8-7-9-20(3)22-11-12-23-21-10-13-25-28(5,24(21)14-16-27(22,23)4)17-15-26(31)29(25,6)18-30/h8,18,20,22-23,25-26,31H,7,9-17H2,1-6H3/t20-,22-,23+,25-,26+,27-,28-,29-/m1/s1
InChIKey GFGANDKVOKQAGH-FSDUGWFMSA-N
SMILES C12=C([C@]3([C@]([C@](CC3)([C@@H](CCC=C(C)C)C)[H])(C)CC1)[H])CC[C@@]4([C@@]2(CC[C@@H]([C@@]4(C=O)C)O)C)[H]
ChEBI Ontology
Outgoing 4β-formyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol (CHEBI:143573) has functional parent 4β-hydroxymethyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol (CHEBI:143572)
4β-formyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol (CHEBI:143573) is a 3β-hydroxy-4β-formyl-4α-methylsteroid (CHEBI:143568)
Synonym Source
4β-formylmethyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol UniProt
Manual Xref Database
CPD-21729 MetaCyc
View more database links
Citation Waiting for Citations Type Source
29784781 PubMed citation SUBMITTER
Last Modified
13 November 2019