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CHEBI:147386 - 2-deoxyecdysone 22-phosphate(2−)

ChEBI IDCHEBI:147386
ChEBI Name2-deoxyecdysone 22-phosphate(2−)
Stars
ASCII Name2-deoxyecdysone 22-phosphate(2-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC27H43O8P
Net Charge-2
Average Mass526.607
Monoisotopic Mass526.27065
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)/p-2/t16-,17-,18+,19-,21-,23+,25+,26+,27+/m0/s1
InChIKeyAOKIBCRWTSJHIE-XNSSJAPWSA-L
ChEBI Ontology
Outgoing Relation(s)
2-deoxyecdysone 22-phosphate(2−) (CHEBI:147386) is a organophosphate oxoanion (CHEBI:58945)
2-deoxyecdysone 22-phosphate(2−) (CHEBI:147386) is conjugate base of 2-deoxyecdysone (CHEBI:19566)
Incoming Relation(s)
2-deoxyecdysone (CHEBI:19566) is conjugate acid of 2-deoxyecdysone 22-phosphate(2−) (CHEBI:147386)
UniProt Name  Source
2-deoxyecdysone 22-phosphateUniProt
Manual XrefsDatabases
CPD-15649MetaCyc
Citations