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> Main
CHEBI:530615 - cidofovir(2−)
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ChEBI Name
cidofovir(2−)
ChEBI ID
CHEBI:530615
ChEBI ASCII Name
cidofovir(2-)
Definition
The dianion obtained by removal of two protons from the phosphonic acid group of cidofovir.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H12N3O6P
Net Charge
-2
Average Mass
277.171
Monoisotopic Mass
277.04747
InChI
InChI=1S/C8H14N3O6P/c9-
7-
1-
2-
11(8(13)
10-
7)
3-
6(4-
12)
17-
5-
18(14,15)
16/h1-
2,6,12H,3-
5H2,(H2,9,10,13)
(H2,14,15,16)
/p-
2/t6-
/m0/s1
InChIKey
VWFCHDSQECPREK-LURJTMIESA-L
SMILES
N=1C(N(C[C@H](OCP(=O)([O-])[O-])CO)C=CC1N)=O
ChEBI Ontology
Outgoing
cidofovir(2−) (
CHEBI:530615
)
is a
organophosphonate oxoanion (
CHEBI:59635
)
cidofovir(2−) (
CHEBI:530615
)
is a
pyrimidone (
CHEBI:38337
)
cidofovir(2−) (
CHEBI:530615
)
is conjugate base of
cidofovir anhydrous (
CHEBI:3696
)
cidofovir(2−) (
CHEBI:530615
)
is conjugate base of
cidofovir(1−) (
CHEBI:134514
)
Incoming
cidofovir anhydrous (
CHEBI:3696
)
is conjugate acid of
cidofovir(2−) (
CHEBI:530615
)
cidofovir(1−) (
CHEBI:134514
)
is conjugate acid of
cidofovir(2−) (
CHEBI:530615
)
IUPAC Name
({[(2
S
)-
1-
(4-
amino-
2-
oxopyrimidin-
1(2
H
)-
yl)-
3-
hydroxypropan-
2-
yl]oxy}methyl)phosphonate
Synonyms
Sources
cidofovir
ChEMBL
cidofovir dianion
ChEBI
Registry Number
Type
Source
4710958
Beilstein Registry Number
Beilstein
Citation
Type
Source
17438061
PubMed citation
ChEMBL
Last Modified
09 May 2017