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Name:Benphothiamine
PubChem ID:3032771
Pathway:Show KEGG pathways
InChI:InChI=1/C19H23N4O6PS/c1-13(23(12-24)11-16-10-21-14(2)22-18(16)20)17(8-9-29-30(26,27)28)31-19(25)15-6-4-3-5-7-15/h3-7,10,12H,8-9,11H2,1-2H3,(H2,20,21,22)(H2,26,27,28)/b17-13-/f/h26-27H,20H2
SMILES:C\C(=C(/CCOP(O)(O)=O)SC(c1ccccc1)=O)N(Cc1cnc(C)nc1N)C=O

Properties:
Formula:C19H23N4O6PSAtoms:31
Molecular Weight:466.448Rotatable Bonds:11
H-bond Acceptors:9H-bond Donors:0
logP:3.8472
Targets:
NameUniprot IDSourceReferencesInteraction
RAC-alpha serine/threonine-protein kinaseAKT1_MOUSEPROMISCUOUSPMID 16416271shows
Synonyms:
22457-89-2
8088 C.B
8088 C.B.
B9636_SIGMA
benfothiamine
Benfotiamina [INN-Spanish]
BENFOTIAMINE
Benfotiamine [DCF:INN:JAN]
Benfotiamine [INN:DCF:JAN]
Benfotiaminum [INN-Latin]
Benphothiamine
Benzoic acid, thio-, S-ester with
Benzoic acid, thio-, S-ester with N-((4-amino-2-methyl-5-pyrimidinyl)methyl)-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide dihydrogen phosphate (ester)
Benzoylthiamine monophosphate
Benzoylthiamine O-monophosphate
Berdi
Betivina
Biotamin
BPBio1_000757
BRN 0771326
BSPBio_000687
BTMP
BTMP-benfo
C19H23N4O6PS
CB 8088
EINECS 245-013-4
LS-38336
N-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide S-benzoate O-phosphate
NCGC00179477-01
Neurostop
Nitanevril
Prestwick2_000654
Prestwick3_000654
Prestwick_68
S-Benzoylthiamine monophosphate
S-Benzoylthiamine O-monophosphate
ST056187
Tabiomyl
Thiamine monophosphate benzoyl
Vitanevril
ATC-Codes: