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ChEBI
> Main
CHEBI:9919 - Valacyclovir hydrochloride
Main
ChEBI Ontology
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ChEBI Name
Valacyclovir hydrochloride
ChEBI ID
CHEBI:9919
Stars
This entity has been manually annotated by a third party.
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Formula
C13H20N6O4.HCl
Net Charge
0
Average Mass
360.800
Monoisotopic Mass
360.13128
InChI
InChI=1S/C13H20N6O4.ClH/c1-
7(2)
8(14)
12(21)
23-
4-
3-
22-
6-
19-
5-
16-
9-
10(19)
17-
13(15)
18-
11(9)
20;/h5,7-
8H,3-
4,6,14H2,1-
2H3,(H3,15,17,18,20)
;1H/t8-
;/m0./s1
InChIKey
ZCDDBUOENGJMLV-QRPNPIFTSA-N
SMILES
Cl.CC(C)[C@H](N)C(=O)OCCOCn1cnc2c1nc(N)[nH]c2=O
ChEBI Ontology
Outgoing
Valacyclovir hydrochloride (
CHEBI:9919
)
is a
organic molecular entity (
CHEBI:50860
)
Synonyms
Sources
BW 256U87
KEGG COMPOUND
Valacyclovir
KEGG COMPOUND
Valacyclovir hydrochloride
KEGG COMPOUND
Manual Xrefs
Databases
C07184
KEGG COMPOUND
D00398
KEGG DRUG
View more database links
Registry Number
Type
Source
124832-27-5
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014