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CHEBI:18532 - (25R)-11α,20,26-trihydroxyecdysone

ChEBI IDCHEBI:18532
ChEBI Name(25R)-11α,20,26-trihydroxyecdysone
Stars
ASCII Name(25R)-11alpha,20,26-trihydroxyecdysone
Last Modified27 September 2007
DownloadsMolfile
FormulaC27H44O9
Net Charge0
Average Mass512.640
Monoisotopic Mass512.29853
SMILES[H][C@]1([C@@](C)(O)[C@H](O)CC[C@@](C)(O)CO)CC[C@@]2(O)C3=CC(=O)[C@]4([H])C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@]3([H])[C@H](O)C[C@]12C
InChIInChI=1S/C27H44O9/c1-23(34,13-28)7-6-21(33)26(4,35)20-5-8-27(36)15-10-16(29)14-9-17(30)18(31)11-24(14,2)22(15)19(32)12-25(20,27)3/h10,14,17-22,28,30-36H,5-9,11-13H2,1-4H3/t14-,17+,18-,19+,20-,21+,22+,23+,24-,25+,26+,27+/m0/s1
InChIKeyKLDBEDBIBHZKCM-VNFJJEEASA-N
ChEBI Ontology
Outgoing Relation(s)
(25R)-11α,20,26-trihydroxyecdysone (CHEBI:18532) has functional parent ecdysone (CHEBI:16688)
(25R)-11α,20,26-trihydroxyecdysone (CHEBI:18532) is a 11α-hydroxy steroid (CHEBI:19129)
(25R)-11α,20,26-trihydroxyecdysone (CHEBI:18532) is a 20-hydroxy steroid (CHEBI:36854)
(25R)-11α,20,26-trihydroxyecdysone (CHEBI:18532) is a 26-hydroxy steroid (CHEBI:36852)
(25R)-11α,20,26-trihydroxyecdysone (CHEBI:18532) is a phytoecdysteroid (CHEBI:26118)
IUPAC Name 
(22R,25R)-2β,3β,11α,14,20,22,25,26-octahydroxy-5β-cholest-7-en-6-one
Registry NumbersSources
Beilstein:8603188Beilstein