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CHEBI:31931 - Olanexidine hydrochloride hydrate
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ChEBI Ontology
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ChEBI Name
Olanexidine hydrochloride hydrate
ChEBI ID
CHEBI:31931
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This entity has been manually annotated by a third party.
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Formulae
2C17H27Cl2N5.2HCl.H2O
C34H58Cl6N10O
Net Charge
0
Average Mass
835.610
Monoisotopic Mass
832.29262
InChI
InChI=1S/2C17H27Cl2N5.2ClH.H2O/c2*1-
2-
3-
4-
5-
6-
7-
10-
22-
16(20)
24-
17(21)
23-
12-
13-
8-
9-
14(18)
15(19)
11-
13;;;/h2*8-
9,11H,2-
7,10,12H2,1H3,(H5,20,21,22,23,24)
;2*1H;1H2
InChIKey
PMKCJSVTNJUCGR-UHFFFAOYSA-N
SMILES
Cl.O.C1=C(C(=CC(=C1)CNC(NC(NCCCCCCCC)=N)=N)Cl)Cl.Cl.C1=C(C(=CC(=C1)CNC(NC(NCCCCCCCC)=N)=N)Cl)Cl
ChEBI Ontology
Outgoing
Olanexidine hydrochloride hydrate (
CHEBI:31931
)
is a
dichlorobenzene (
CHEBI:23697
)
Synonym
Source
Olanexidine hydrochloride hydrate
KEGG COMPOUND
Manual Xref
Database
D01857
KEGG DRUG
View more database links
Registry Number
Type
Source
218282-71-4
CAS Registry Number
KEGG COMPOUND
Last Modified
06 March 2017