CHEBI:233646 - EB1002

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ChEBI Name EB1002
ChEBI ID CHEBI:233646
Definition EB1002 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.
Stars This entity has been manually annotated by a third party.
Submitter Laureen Bonaobra
Supplier Information ChemicalBook:CB23152557, eMolecules:2720067, ZINC000000062796
Download Molfile XML SDF
Formula C73H124N12O23
Net Charge 0
Average Mass 1537.856
Monoisotopic Mass 1536.89023
InChI InChI=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
InChIKey SMIDDQXCMJFZEC-PPTFQZPPSA-N
SMILES O=C(O)CCCCCCCCCCCCCCCCC(=O)NC(C(=O)O)CCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N(C)C(C(=O)NC(C(=O)N)CCOC)CC(C)C)C(C)C)CC1=CC=C(O)C=C1)CCCCN)CC(=O)O
ChEBI Ontology
Outgoing EB1002 (CHEBI:233646) is a organic molecular entity (CHEBI:50860)
Synonym Source
2770688-48-5 SUBMITTER
Registry Number Type Source
2770688-48-5 CAS Registry Number SUBMITTER