CHEBI:16587 - 20-hydroxyecdysone

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ChEBI Name 20-hydroxyecdysone
ChEBI ID CHEBI:16587
Definition An ecdysteroid that is ecdysone substituted by a hydroxy group at position 20.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:49387, CHEBI:11661, CHEBI:1292, CHEBI:19795, CHEBI:57827
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Formula C27H44O7
Net Charge 0
Average Mass 480.63406
Monoisotopic Mass 480.309
InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
InChIKey NKDFYOWSKOHCCO-YPVLXUMRSA-N
SMILES [H][C@]12CC[C@]3(C)[C@]([H])(CC[C@@]3(O)C1=CC(=O)[C@]1([H])C[C@@H](O)[C@@H](O)C[C@]21C)[C@@](C)(O)[C@H](O)CCC(C)(C)O
Metabolite of Species Details
Manduca sexta (NCBI:7130) See: PubMed
Roles Classification
Biological Role(s): 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.
hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via ecdysteroid )
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ChEBI Ontology
Outgoing 20-hydroxyecdysone (CHEBI:16587) has functional parent ecdysone (CHEBI:16688)
20-hydroxyecdysone (CHEBI:16587) has role animal metabolite (CHEBI:75767)
20-hydroxyecdysone (CHEBI:16587) has role plant metabolite (CHEBI:76924)
20-hydroxyecdysone (CHEBI:16587) is a 14α-hydroxy steroid (CHEBI:36861)
20-hydroxyecdysone (CHEBI:16587) is a 2β-hydroxy steroid (CHEBI:36859)
20-hydroxyecdysone (CHEBI:16587) is a 20-hydroxy steroid (CHEBI:36854)
20-hydroxyecdysone (CHEBI:16587) is a 22-hydroxy steroid (CHEBI:36863)
20-hydroxyecdysone (CHEBI:16587) is a 25-hydroxy steroid (CHEBI:36864)
20-hydroxyecdysone (CHEBI:16587) is a 3β-sterol (CHEBI:35348)
20-hydroxyecdysone (CHEBI:16587) is a ecdysteroid (CHEBI:23897)
20-hydroxyecdysone (CHEBI:16587) is a phytoecdysteroid (CHEBI:26118)
IUPAC Name
(22R)-2β,3β,14α,20,22,25-hexahydroxy-5β-cholest-7-en-6-one
Synonyms Sources
20-hydroxyecdysone UniProt
20-Hydroxyecdysone KEGG COMPOUND
20-OH ecdysone ChEBI
beta-Ecdysone ChemIDplus
beta-Ecdysterone ChemIDplus
Crustecdysone KEGG COMPOUND
Ecdysterone KEGG COMPOUND
Database Links Databases
20-Hydroxyecdysone Wikipedia
20E PDBeChem
C00003654 KNApSAcK
C02633 KEGG COMPOUND
CPD-276 MetaCyc
HMDB30180 HMDB
LMST01010209 LIPID MAPS
View more database links
Registry Numbers Types Sources
1917578 Reaxys Registry Number Reaxys
5289-74-7 CAS Registry Number KEGG COMPOUND
5289-74-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
15609826 PubMed citation Europe PMC
25593010 PubMed citation Europe PMC
8748375 PubMed citation Europe PMC
Last Modified
02 February 2015