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CHEBI:19567 - 2-deoxyecdysone 22-phosphate

Default Structure
ChEBI IDCHEBI:19567
ChEBI Name2-deoxyecdysone 22-phosphate
Stars
Last Modified11 December 2007
DownloadsMolfile
FormulaC27H45O8P
Net Charge0
Average Mass528.623
Monoisotopic Mass528.28521
SMILES[H][C@@]12C[C@@H](O)CC[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@](O)(CC[C@]3([H])[C@H](C)[C@@H](CCC(C)(C)O)OP(=O)(O)O)C1=CC2=O
InChIInChI=1S/C27H45O8P/c1-16(23(35-36(32,33)34)9-10-24(2,3)30)18-8-13-27(31)20-15-22(29)21-14-17(28)6-11-25(21,4)19(20)7-12-26(18,27)5/h15-19,21,23,28,30-31H,6-14H2,1-5H3,(H2,32,33,34)/t16-,17-,18+,19-,21-,23+,25+,26+,27+/m0/s1
InChIKeyAOKIBCRWTSJHIE-XNSSJAPWSA-N
ChEBI Ontology
Outgoing Relation(s)
2-deoxyecdysone 22-phosphate (CHEBI:19567) is a ecdysone phosphate (CHEBI:23893)
IUPAC Name 
(22R)-3β,14,25-trihydroxy-6-oxo-5β-cholest-7-en-22-yl dihydrogen phosphate
Synonym  Source
2-Deoxyecdysone-22-phosphateChemIDplus
Registry NumbersSources
CAS:82183-63-9ChemIDplus