CHEBI:189052 - carbovir diphosphate(3−)

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ChEBI Name carbovir diphosphate(3−)
ChEBI ID CHEBI:189052
ChEBI ASCII Name carbovir diphosphate(3-)
Definition An organophosphate oxoanion that is the trianion of carbovir diphosphate, arising from deprotonation of the diphosphate OH groups; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H12N5O8P2
Net Charge -3
Average Mass 404.193
Monoisotopic Mass 404.01776
InChI InChI=1S/C11H15N5O8P2/c12-11-14-9-8(10(17)15-11)13-5-16(9)7-2-1-6(3-7)4-23-26(21,22)24-25(18,19)20/h1-2,5-7H,3-4H2,(H,21,22)(H2,18,19,20)(H3,12,14,15,17)/p-3/t6-,7+/m1/s1
InChIKey LBDJPXUIKREEKI-RQJHMYQMSA-K
SMILES NC1=NC2=C(N=CN2[C@@H]2C[C@H](COP([O-])(=O)OP([O-])([O-])=O)C=C2)C(=O)N1
ChEBI Ontology
Outgoing carbovir diphosphate(3−) (CHEBI:189052) is a organophosphate oxoanion (CHEBI:58945)
carbovir diphosphate(3−) (CHEBI:189052) is conjugate base of carbovir diphosphate (CHEBI:64172)
Incoming carbovir diphosphate (CHEBI:64172) is conjugate acid of carbovir diphosphate(3−) (CHEBI:189052)
IUPAC Name
({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)phosphonate
Synonyms Sources
(−)-carbovir 5'-diphosphate trianion ChEBI
(−)-carbovir diphosphate trianion ChEBI
carbovir 5'-diphosphate trianion ChEBI
carbovir diphosphate trianion ChEBI
Last Modified
12 January 2022