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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:135351 - rotigotine
Main
ChEBI Ontology
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ChEBI Name
rotigotine
ChEBI ID
CHEBI:135351
Stars
This entity has been manually annotated by a third party.
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Formula
C19H25NOS
Net Charge
0
Average Mass
315.475
Monoisotopic Mass
315.16569
InChI
InChI=1S/C19H25NOS/c1-
2-
11-
20(12-
10-
17-
6-
4-
13-
22-
17)
16-
8-
9-
18-
15(14-
16)
5-
3-
7-
19(18)
21/h3-
7,13,16,21H,2,8-
12,14H2,1H3/t16-
/m0/s1
InChIKey
KFQYTPMOWPVWEJ-INIZCTEOSA-N
SMILES
OC1=C2C(C[C@H](CC2)N(CCC3=CC=CS3)CCC)=CC=C1
ChEBI Ontology
Outgoing
rotigotine (
CHEBI:135351
)
is a
tetralins (
CHEBI:36786
)
Synonyms
Sources
(S)-(-)-Rotigotine
DrugCentral
leganto
DrugCentral
neupro
DrugCentral
Manual Xref
Database
2407
DrugCentral
View more database links
Registry Number
Type
Source
99755-59-6
CAS Registry Number
DrugCentral
Last Modified
23 February 2017