CHEBI:127781 - 17-(4-hydroxyphenyl)heptadecanoyl-AMP

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 17-(4-hydroxyphenyl)heptadecanoyl-AMP
ChEBI ID CHEBI:127781
Definition An acyclic mixed acid anhydride that results from the formal condensation of the phosphoryl group of AMP with the carboxy group of 17-(4-hydroxyphenyl)heptadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C33H50N5O9P
Net Charge 0
Average Mass 691.753
Monoisotopic Mass 691.33462
InChI InChI=1S/C33H50N5O9P/c34-31-28-32(36-22-35-31)38(23-37-28)33-30(42)29(41)26(46-33)21-45-48(43,44)47-27(40)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-24-17-19-25(39)20-18-24/h17-20,22-23,26,29-30,33,39,41-42H,1-16,21H2,(H,43,44)(H2,34,35,36)/t26-,29-,30-,33-/m1/s1
InChIKey SNPFUIGRBWOCGB-FTBITJBVSA-N
SMILES C(CCCCCCCCCCCCCCCCC1=CC=C(C=C1)O)(=O)OP(OC[C@H]2O[C@@H](N3C=4N=CN=C(N)C4N=C3)[C@@H]([C@@H]2O)O)(=O)O
ChEBI Ontology
Outgoing 17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) has functional parent 17-(4-hydroxyphenyl)heptadecanoic acid (CHEBI:127343)
17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) is a acyclic mixed acid anhydride (CHEBI:37787)
17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) is a adenosine 5'-phosphate (CHEBI:37096)
17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) is a purine ribonucleoside 5'-monophosphate (CHEBI:37021)
17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781) is conjugate acid of 17-(4-hydroxyphenyl)heptadecanoyl-AMP(1−) (CHEBI:91234)
Incoming 17-(4-hydroxyphenyl)heptadecanoyl-AMP(1−) (CHEBI:91234) is conjugate base of 17-(4-hydroxyphenyl)heptadecanoyl-AMP (CHEBI:127781)
IUPAC Name
5'-O-(hydroxy{[17-(4-hydroxyphenyl)heptadecanoyl]oxy}phosphoryl)adenosine
Synonym Source
17-(4-hydroxyphenyl)heptadecanoyl adenylate MetaCyc
Manual Xref Database
CPD-18624 MetaCyc
View more database links
Last Modified
18 October 2018