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Chemical structure of Oxythiamine

GC33316

Oxythiamine

Also listed as Oxythiamine (Hydroxythiamin)

Oxythiamine (Hydroxythiamin), an antimetabolite and a vitamin B1 antagonist, is a well-known thiamine antagonist and inhibitor of transketolase

ChemicalCAS136-16-3MW266.34FormulaC12H16N3O2S
CAS number
136-16-3
Molecular weight
266.34
Formula
C12H16N3O2S
Solubility
DMSO ： 51·67 mg/mL (194·00 mM)
InChIKey
SRDGSXVLAVRBLU-UHFFFAOYSA-O
Catalogue number
GC33316
Brand
GLPBIO
Computed properties PubChem CID 8682 · XLogP 0.1 · TPSA 93.8 Ų · H-bond donors 2
XLogP
0.1
TPSA
93.8 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18

SMILES CC1=C(SC=[N+]1CC2=CN=C(NC2=O)C)CCO

Computed descriptors from PubChem (CID 8682), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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