CHEBI:137057 - cholesta-5,7-dien-3β,25-diol

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name cholesta-5,7-dien-3β,25-diol ChEBI ID CHEBI:137057 ChEBI ASCII Name cholesta-5,7-dien-3beta,25-diol Definition A cholestanoid that is 7-dehydrocholesterol carrying an additional hydroxy substituent at position 25. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H44O2 Net Charge 0 Average Mass 400.638 Monoisotopic Mass 400.33413 InChI InChI=1S/C27H44O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h8-9,18,20,22-24,28-29H,6-7,10-17H2,1-5H3/t18-,20+,22-,23+,24+,26+,27-/m1/s1 InChIKey JJFYNCJHSCTBPW-TVQCKQBJSA-N SMILES C1[C@@]2([C@]3(CC[C@]4([C@](C3=CC=C2C[C@H](C1)O)(CC[C@@]4([C@@H](CCCC(C)(C)O)C)[H])[H])C)[H])C Metabolite of Species Details Saccharomyces cerevisiae (NCBI:txid4932) See: PubMed Manduca sexta (NCBI:txid7130) See: PubMed Drosophila melanogaster (NCBI:txid7227) See: PubMed Homo sapiens (NCBI:txid9606) See: PubMed Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). View more via ChEBI Ontology ChEBI Ontology Outgoing cholesta-5,7-dien-3β,25-diol (CHEBI:137057) has functional parent cholesta-5,7-dien-3β-ol (CHEBI:17759) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) has role human metabolite (CHEBI:77746) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) is a 25-hydroxy steroid (CHEBI:36864) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) is a C27-steroid (CHEBI:131619) cholesta-5,7-dien-3β,25-diol (CHEBI:137057) is a cholestanoid (CHEBI:50401) IUPAC Name cholesta-5,7-dien-3β,25-diol Synonyms Sources (3β)-cholesta-5,7-diene-3,25-diol IUPAC 25-Hydroxy-7-dehydrocholesterol ChemIDplus 25-Hydroxyprovitamin D3 ChemIDplus 25-OH-7-DHC SUBMITTER 3β,25-dihydroxycholesta-5,7-diene ChEBI 7-Dehydro-25-hydroxycholesterol ChemIDplus cholesta-5,7-dien-3β,25-diol UniProt Cholesta-5,7-diene-3beta,25-diol ChemIDplus Manual Xrefs Databases WO2011067144 Patent WO9321204 Patent View more database links Registry Numbers Types Sources 22145-68-2 CAS Registry Number ChemIDplus 5122777 Reaxys Registry Number Reaxys Citations Types Sources 10406093 PubMed citation Europe PMC 11476936 PubMed citation Europe PMC 25017465 PubMed citation SUBMITTER 26638999 PubMed citation Europe PMC 675737 PubMed citation Europe PMC 9014337 PubMed citation Europe PMC 9014338 PubMed citation Europe PMC 944193 PubMed citation Europe PMC Last Modified 08 August 2017