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

ChEBI IDCHEBI:142845
ChEBI Name4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-ol
Stars
ASCII Name4alpha-formyl-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-cholest-24-en-3beta-ol
DefinitionA 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.
Last Modified13 November 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H48O2
Net Charge0
Average Mass440.712
Monoisotopic Mass440.36543
SMILES[H][C@@]12CC[C@]3([H])[C@@]4(CC[C@H](O)[C@@]3(C)C=O)C[C@@]14CC[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)CCC=C(C)C
InChIInChI=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
InChIKeyHPCOTHKWIJPKNI-BPYUMQNDSA-N
ChEBI Ontology
Outgoing Relation(s)
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)
UniProt Name  Source
4α-formyl-4β,14α-dimethyl-9β,19-cyclo-5α-cholest-24-en-3β-olUniProt
Manual XrefsDatabases
CPD-12918MetaCyc
Citations