CHEBI:173025 - 24-ethyl-26-norcholesta-5,22E,25-trien-3beta-ol

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 24-ethyl-26-norcholesta-5,22E,25-trien-3beta-ol
ChEBI ID CHEBI:173025
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H44O
Net Charge 0
Average Mass 396.659
Monoisotopic Mass 396.33922
InChI InChI=1S/C28H44O/c1-6-20(7-2)9-8-19(3)24-12-13-25-23-11-10-21-18-22(29)14-16-27(21,4)26(23)15-17-28(24,25)5/h6,8-10,19-20,22-26,29H,1,7,11-18H2,2-5H3/b9-8+/t19-,20?,22+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey SUKGHHZYOKXZRR-LZVHCVFPSA-N
SMILES O[C@@H]1CC=2[C@@]([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@H](C)/C=C/C(CC)C=C)[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in brain (BTO:0000142). of strain C57BL/6J [EFO:0000606] See: MetaboLights Study
ChEBI Ontology
Outgoing 24-ethyl-26-norcholesta-5,22E,25-trien-3beta-ol (CHEBI:173025) has parent hydride stigmastane (CHEBI:26773)
24-ethyl-26-norcholesta-5,22E,25-trien-3beta-ol (CHEBI:173025) is a steroid (CHEBI:35341)
IUPAC Name
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,3E)-5-ethylhepta-3,6-dien-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual Xrefs Databases
29216149 ChemSpider
LMST01040156 LIPID MAPS
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