UCSF

ZINC12495212

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 30 No

Popular Name: Thiamine triphosphate Thiamine triphosphate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 15666-52-1 , 3475-65-8

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL

Vendor Notes

Note Type Comments Provided By
UniProt Database Links COFE_METJA; ENPP1_HUMAN; ENPP1_MOUSE; ENPP1_RAT; ENTP4_HUMAN; IDE_HUMAN; MOBB_ECOLI; NCPP_ECOLI; NDT1_ARATH; NDT2_ARATH; NTPA_METJA; NTPCR_BOVIN; NTPCR_HUMAN; NTPCR_MOUSE; NTPTH_AERPE; NTPTH_AQUAE; NTPTH_ARCFU; NTPTH_CALMQ; NTPTH_HYPBU; NTPTH_IGNH4; NTPTH ChEBI
Reactome Database Links REACT_25070; REACT_25137 ChEBI
UniProt Database Links THTPA_BOVIN; THTPA_HUMAN; THTPA_MACFA; THTPA_MOUSE; THTPA_RAT ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Vitamin B1 (thiamin) metabolism

Analogs ( Draw Identity 99% 90% 80% 70% )