CHEBI:7718 - Ochotensine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Ochotensine
ChEBI ID CHEBI:7718
Stars This entity has been manually annotated by a third party.
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Formula C21H21NO4
Net Charge 0
Average Mass 351.397
Monoisotopic Mass 351.14706
InChI InChI=1S/C21H21NO4/c1-12-14-4-5-18-20(26-11-25-18)15(14)10-21(12)16-9-19(24-3)17(23)8-13(16)6-7-22(21)2/h4-5,8-9,23H,1,6-7,10-11H2,2-3H3/t21-/m0/s1
InChIKey MDAWGFZRYVVBAS-NRFANRHFSA-N
SMILES COc1cc2c(CCN(C)[C@]22Cc3c(ccc4OCOc34)C2=C)cc1O
ChEBI Ontology
Outgoing Ochotensine (CHEBI:7718) is a isoquinolines (CHEBI:24922)
Synonym Source
Ochotensine KEGG COMPOUND
Manual Xrefs Databases
C00001896 KNApSAcK
C09597 KEGG COMPOUND
View more database links
Registry Number Type Source
4959-88-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014