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CHEBI:233646 - EB1002

Default Structure
ChEBI IDCHEBI:233646
ChEBI NameEB1002
Stars
DefinitionEB1002 is a selective NK2R agonist. EB1002 significantly raises the expression levels of mitochondrial biosynthesis-related genes (like PGC-1alpha) in obese mice, indicating that it promotes energy expenditure by boosting mitochondrial activity. EB1002 also increases the insulin sensitivity and improves glycolipid metabolism of the mice. EB1002 is promising for research of obesity and type 2 diabetes.
Submitterlbonaobra
DownloadsMolfile
FormulaC73H124N12O23
Net Charge0
Average Mass1537.856
Monoisotopic Mass1536.89023
SMILESCOCC[C@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(C)C)C(N)=O
InChIInChI=1S/C73H124N12O23/c1-49(2)43-58(71(100)81-53(67(75)96)32-36-104-6)85(5)63(91)46-78-72(101)66(50(3)4)84-70(99)56(44-51-26-28-52(86)29-27-51)83-68(97)54(23-21-22-33-74)82-69(98)57(45-65(94)95)80-62(90)48-108-42-40-106-38-35-77-61(89)47-107-41-39-105-37-34-76-59(87)31-30-55(73(102)103)79-60(88)24-19-17-15-13-11-9-7-8-10-12-14-16-18-20-25-64(92)93/h26-29,49-50,53-58,66,86H,7-25,30-48,74H2,1-6H3,(H2,75,96)(H,76,87)(H,77,89)(H,78,101)(H,79,88)(H,80,90)(H,81,100)(H,82,98)(H,83,97)(H,84,99)(H,92,93)(H,94,95)(H,102,103)/t53-,54-,55-,56-,57-,58-,66-/m0/s1
InChIKeySMIDDQXCMJFZEC-PPTFQZPPSA-N
ChEBI Ontology
Outgoing Relation(s)
EB1002 (CHEBI:233646) is a organic molecular entity (CHEBI:50860)
Synonym  Source
2770688-48-5SUBMITTER
Registry NumbersSources
CAS:2770688-48-5SUBMITTER