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CHEBI:80761 - beta-Phenylalanoyl-CoA

ChEBI IDCHEBI:80761
ChEBI Namebeta-Phenylalanoyl-CoA
Stars
DownloadsMolfile
FormulaC30H45N8O17P3S
Net Charge0
Average Mass914.718
Monoisotopic Mass914.18362
SMILESCC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)C[C@@H](N)c1ccccc1
InChIInChI=1S/C30H45N8O17P3S/c1-30(2,25(42)28(43)34-9-8-20(39)33-10-11-59-21(40)12-18(31)17-6-4-3-5-7-17)14-52-58(49,50)55-57(47,48)51-13-19-24(54-56(44,45)46)23(41)29(53-19)38-16-37-22-26(32)35-15-36-27(22)38/h3-7,15-16,18-19,23-25,29,41-42H,8-14,31H2,1-2H3,(H,33,39)(H,34,43)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/t18-,19-,23-,24-,25?,29-/m1/s1
InChIKeySUUAAMNYLVZHRN-HMFIDMSVSA-N
ChEBI Ontology
Outgoing Relation(s)
beta-Phenylalanoyl-CoA (CHEBI:80761) is a organic molecule (CHEBI:72695)
Synonyms  Source
(R)-3-Amino-3-phenylpropanoyl-CoAKEGG COMPOUND
(R)-beta-Phenylalanoyl-CoAKEGG COMPOUND
Amino phenylpropanoyl-CoAKEGG COMPOUND
Manual XrefsDatabases
C16833KEGG COMPOUND