CHEBI:2735 - Anisodamine

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ChEBI Name Anisodamine
ChEBI ID CHEBI:2735
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H23NO4
Net Charge 0
Average Mass 305.369
Monoisotopic Mass 305.16271
InChI InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12?,13-,14-,15?,16-/m0/s1
InChIKey WTQYWNWRJNXDEG-ABSNHQIMSA-N
SMILES CN1C2C[C@H](O)C1C[C@H](C2)OC(=O)[C@@H](CO)c1ccccc1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Anisodamine (CHEBI:2735) is a monocarboxylic acid (CHEBI:25384)
Synonyms Sources
6-Hydroxyhyoscyamine KEGG COMPOUND
Anisodamine KEGG COMPOUND
Manual Xrefs Databases
C00002274 KNApSAcK
C10842 KEGG COMPOUND
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Registry Number Type Source
55869-99-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014