CHEBI:34716 - Dimethylaminoethyl reserpilinate dihydrochloride

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Dimethylaminoethyl reserpilinate dihydrochloride
ChEBI ID CHEBI:34716
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C26H35N3O5.2HCl
Net Charge 0
Average Mass 542.496
Monoisotopic Mass 541.21103
InChI InChI=1S/C26H35N3O5.2ClH/c1-15-19-13-29-7-6-16-18-11-23(31-4)24(32-5)12-21(18)27-25(16)22(29)10-17(19)20(14-34-15)26(30)33-9-8-28(2)3;;/h11-12,14-15,17,19,22,27H,6-10,13H2,1-5H3;2*1H/t15-,17-,19-,22+;;/m0../s1
InChIKey RDKIYVYHCBJDMF-DGCKWTARSA-N
SMILES C1(=C(C=C2C(=C1)C3=C(N2)[C@]4(C[C@@]5(C(=CO[C@H]([C@@]5(CN4CC3)[H])C)C(OCCN(C)C)=O)[H])[H])OC)OC.Cl.Cl
ChEBI Ontology
Outgoing Dimethylaminoethyl reserpilinate dihydrochloride (CHEBI:34716) is a polymer (CHEBI:60027)
Synonyms Sources
Dimethylaminoethyl reserpilinate dihydrochloride KEGG COMPOUND
Paratensiol KEGG COMPOUND
Manual Xrefs Databases
C13441 KEGG COMPOUND
D01950 KEGG DRUG
View more database links
Registry Number Type Source
3735-84-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014