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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:135091 - pentifylline
Main
ChEBI Ontology
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ChEBI Name
pentifylline
ChEBI ID
CHEBI:135091
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This entity has been manually annotated by a third party.
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Formula
C13H20N4O2
Net Charge
0
Average Mass
264.324
Monoisotopic Mass
264.15863
InChI
InChI=1S/C13H20N4O2/c1-4-5-6-7-8-17-12(18)10-11(14-9-15(10)2)16(3)13(17)19/h9H,4-8H2,1-3H3
InChIKey
MRWQRJMESRRJJB-UHFFFAOYSA-N
SMILES
O=C1C2=C(N(C(N1CCCCCC)=O)C)N=CN2C
ChEBI Ontology
Outgoing
pentifylline (
CHEBI:135091
)
is a
oxopurine (
CHEBI:25810
)
Synonyms
Sources
1-Hexyltheobromine
DrugCentral
hexyltheobromine
DrugCentral
Manual Xref
Database
2094
DrugCentral
View more database links
Registry Number
Type
Source
1028-33-7
CAS Registry Number
DrugCentral
Last Modified
23 February 2017