CHEBI:142845 - 4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol

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ChEBI Name 4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol
ChEBI ID CHEBI:142845
ChEBI ASCII Name 4alpha-formyl-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-cholest-24-en-3beta-ol
Definition A 3β-hydroxy-4α-formyl-4β-methylsteroid that is 9β-9,19-cyclolanost-24-ene-3β,28-diol in which the hydroxy group at position 28 has been oxidised to the corresponding aldehyde.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
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Formula C30H48O2
Net Charge 0
Average Mass 440.712
Monoisotopic Mass 440.36543
InChI InChI=1S/C30H48O2/c1-20(2)8-7-9-21(3)22-12-14-28(6)24-11-10-23-26(4,19-31)25(32)13-15-29(23)18-30(24,29)17-16-27(22,28)5/h8,19,21-25,32H,7,9-18H2,1-6H3/t21-,22-,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1
InChIKey HPCOTHKWIJPKNI-BPYUMQNDSA-N
SMILES [C@]123[C@]([C@]4([C@]([C@](CC4)([C@@H](CCC=C(C)C)C)[H])(C)CC1)C)(CC[C@@]5([C@@]2(CC[C@@H]([C@]5(C=O)C)O)C3)[H])[H]
ChEBI Ontology
Outgoing 4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol (CHEBI:142845) has functional parent 9β-9,19-cyclolanost-24-ene-3β,28-diol (CHEBI:142844)
4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol (CHEBI:142845) is a 3β-hydroxy-4α-formyl-4β-methylsteroid (CHEBI:145353)
4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol (CHEBI:142845) is a pentacyclic triterpenoid (CHEBI:25872)
Synonym Source
4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol UniProt
Manual Xref Database
CPD-12918 MetaCyc
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Citations Waiting for Citations Types Sources
8505296 PubMed citation SUBMITTER
9240456 PubMed citation SUBMITTER
Last Modified
13 November 2019