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> Main
CHEBI:80610 - 6-Mercaptopurine ribonucleoside 5'-diphosphate
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ChEBI Ontology
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ChEBI Name
6-Mercaptopurine ribonucleoside 5'-diphosphate
ChEBI ID
CHEBI:80610
Stars
This entity has been manually annotated by a third party.
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Formula
C10H14N4O10P2S
Net Charge
0
Average Mass
444.25100
Monoisotopic Mass
443.99059
InChI
InChI=1S/C10H14N4O10P2S/c15-
6-
4(1-
22-
26(20,21)
24-
25(17,18)
19)
23-
10(7(6)
16)
14-
3-
13-
5-
8(14)
11-
2-
12-
9(5)
27/h2-
4,6-
7,10,15-
16H,1H2,(H,20,21)
(H,11,12,27)
(H2,17,18,19)
/t4-
,6-
,7-
,10-
/m1/s1
InChIKey
MHJZYMCYLFGDRD-KQYNXXCUSA-N
SMILES
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1cnc2c(S)ncnc12
ChEBI Ontology
Outgoing
6-Mercaptopurine ribonucleoside 5'-diphosphate (
CHEBI:80610
)
is a
organic molecule (
CHEBI:72695
)
Synonym
Source
6-Thioinosine-5'-diphosphate
KEGG COMPOUND
Manual Xrefs
Databases
C16616
KEGG COMPOUND
HMDB0060660
HMDB
View more database links
Registry Number
Type
Source
805-63-0
CAS Registry Number
KEGG COMPOUND