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CHEBI:28604 - isofucosterol

ChEBI IDCHEBI:28604
ChEBI Nameisofucosterol
Stars
DefinitionA 3β-sterol consisting of stigmastan-3β-ol with double bonds at positions 5 and 24(28). The double bond at postion 24(28) adopts a Z-configuration.
Secondary ChEBI IDsCHEBI:6016, CHEBI:10541, CHEBI:24895
Last Modified24 November 2020
DownloadsMolfile
FormulaC29H48O
Net Charge0
Average Mass412.702
Monoisotopic Mass412.37052
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC/C(=C/C)C(C)C
InChIInChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,19-20,23-27,30H,8-9,11-18H2,1-6H3/b21-7-/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChIKeyOSELKOCHBMDKEJ-WGMIZEQOSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Bombyx mori (ncbitaxon:7091) - DOI (10.1007/BF01959847)
Apis mellifera (ncbitaxon:7460) - DOI (10.1016/0022-1910(80)90136-5)
Euphorbia peplus (ncbitaxon:38846) - DOI (10.1016/S0031-9422(00)85956-7)
Gracilaria foliifera (ncbitaxon:191042) - Article (Alarif, Walied M.; Ayyad, Seif-Eldin. N. and Al-Lihaibi, Sultan S. Acyclic diterpenoid from the red alga Gracilaria foliifera. Rev. latinoam. quím [online]. 2010, vol.38, n.1, pp.52-57. ISSN 0370-5943.)
Xestospongia testudinaria (ncbitaxon:178554) - DOI (10.1021/ja00009a046)
Equisetum arvense (ncbitaxon:3258) cell suspension culture (BTO:0000221) PubMed (6529502)
Gynostemma pentaphyllum (ncbitaxon:182084) - PubMed (2775538)
Solanaceae (ncbitaxon:4070) seed (BTO:0001226) PubMed (595039)
Sargassum thunbergii (ncbitaxon:127542) - PubMed (24684169)
Roles Classification
Biological Roles:
algal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
ChEBI Ontology
Outgoing Relation(s)
isofucosterol (CHEBI:28604) has parent hydride stigmastane (CHEBI:26773)
isofucosterol (CHEBI:28604) has role algal metabolite (CHEBI:84735)
isofucosterol (CHEBI:28604) has role animal metabolite (CHEBI:75767)
isofucosterol (CHEBI:28604) has role marine metabolite (CHEBI:76507)
isofucosterol (CHEBI:28604) has role plant metabolite (CHEBI:76924)
isofucosterol (CHEBI:28604) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
isofucosterol (CHEBI:28604) is a 3β-sterol (CHEBI:35348)
isofucosterol (CHEBI:28604) is a C29-steroid (CHEBI:188923)
isofucosterol (CHEBI:28604) is a phytosterols (CHEBI:26125)
IUPAC Name 
(24Z)-stigmasta-5,24(28)-dien-3β-ol
Synonyms  Source
Δ5-avenasterolKEGG COMPOUND
delta5-avenasterolKEGG COMPOUND
isofucosterolLIPID MAPS
(Z)-24-ethylidenecholesterolHMDB
(24Z)-ethylidenecholesterolChemIDplus
28-isofucosterolChemIDplus
Manual XrefsDatabases
C08821KEGG COMPOUND
C00003656KNApSAcK
CPD-4127MetaCyc
HMDB0002374HMDB
LMST01040145LIPID MAPS
FDB012493FooDB
IsofucosterolWikipedia
Registry NumbersSources
CAS:481-14-1ChemIDplus
CAS:18472-36-1ChemIDplus
CAS:481-14-1NIST Chemistry WebBook
Citations