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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > organooxygen compound > ester > phosphoric ester > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > steroid phosphate > ecdysone phosphate > 3-o-acetylecdysone 2-phosphate

Preferred term

3-o-acetylecdysone 2-phosphate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C29H47O10P

inchi

  • InChI=1S/C29H47O10P/c1-16(22(31)9-10-26(3,4)33)18-8-12-29(34)20-13-23(32)21-14-24(38-17(2)30)25(39-40(35,36)37)15-27(21,5)19(20)7-11-28(18,29)6/h13,16,18-19,21-22,24-25,31,33-34H,7-12,14-15H2,1-6H3,(H2,35,36,37)/t16-,18+,19-,21-,22+,24+,25-,27+,28+,29+/m0/s1

inchikey

  • MYOZIWALDKJCBG-KXCOSXAXSA-N

mass

  • 586.65124

monoisotopicmass

  • 586.29068

smiles

  • [H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4([H])C[C@@H](OC(C)=O)[C@H](C[C@]4(C)[C@@]3([H])CC[C@]12C)OP(O)(O)=O)[C@H](C)[C@H](O)CCC(C)(C)O

subset

  • 3_STAR

synonym EXACT

  • (22R)-14,22,25-trihydroxy-6-oxo-2beta-(phosphonooxy)-5beta-cholest-7-en-3beta-yl acetate

synonym RELATED

  • 3-acetylecdysone 2-phosphate
  • ecdysone 2-phosphate 3-acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:19954

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