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CHEBI:91190 - GS4012 free base
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ChEBI Name
GS4012 free base
ChEBI ID
CHEBI:91190
Definition
A member of the class of pyridines that is 2-(pyridin-4-yl)ethane-1-thiol in which the thiol hydrogen is replaced by a 4-methoxyphenyl group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C14H15NOS
Net Charge
0
Average Mass
245.342
Monoisotopic Mass
245.08744
InChI
InChI=1S/C14H15NOS/c1-16-13-2-4-14(5-3-13)17-11-8-12-6-9-15-10-7-12/h2-7,9-10H,8,11H2,1H3
InChIKey
IUWQYMDPRUPDGB-UHFFFAOYSA-N
SMILES
C=1C=NC=CC1CCSC=2C=CC(=CC2)OC
Roles Classification
Biological Role
(s):
VEGF activator
Any activator of vascular endothelial growth factor (VEGF).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
GS4012 free base (
CHEBI:91190
)
has role
VEGF activator (
CHEBI:91189
)
GS4012 free base (
CHEBI:91190
)
is a
aryl sulfide (
CHEBI:35683
)
GS4012 free base (
CHEBI:91190
)
is a
monomethoxybenzene (
CHEBI:25235
)
GS4012 free base (
CHEBI:91190
)
is a
pyridines (
CHEBI:26421
)
GS4012 free base (
CHEBI:91190
)
is conjugate base of
GS4012 free base(1+) (
CHEBI:91191
)
Incoming
GS4012 free base(1+) (
CHEBI:91191
)
is conjugate acid of
GS4012 free base (
CHEBI:91190
)
IUPAC Name
4-{2-[(4-methoxyphenyl)sulfanyl]ethyl}pyridine
Registry Number
Type
Source
11344081
Reaxys Registry Number
Reaxys
Last Modified
15 February 2016