Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-17 23:40:20 UTC
Update Date2022-08-31 17:16:42 UTC
Metabolite IDMMDBc0029756
Metabolite Identification
Common Namealpha,alpha-Trehalose 6-phosphate
DescriptionTrehalose 6-phosphate is synthesized by the E. coli gene product of otsA. It catalyzes the transfer of glucose from UDP-glucose to glucose-6-phosphate to form alpha,alpha-1,1 trehalose-6-phosphate.
Structure
Synonyms
ValueSource
a,a-Trehalose 6-phosphateGenerator
a,a-Trehalose 6-phosphoric acidGenerator
alpha,alpha-Trehalose 6-phosphoric acidGenerator
Α,α-trehalose 6-phosphateGenerator
Α,α-trehalose 6-phosphoric acidGenerator
Trehalose-6-phosphateMeSH
Molecular FormulaC12H23O14P
Average Mass422.2764
Monoisotopic Mass422.082541956
IUPAC Name[(3,4,5-trihydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methoxy]phosphonic acid
Traditional Name(3,4,5-trihydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methoxyphosphonic acid
CAS Registry Number4484-88-2
SMILES
OCC1OC(OC2OC(COP(O)(O)=O)C(O)C(O)C2O)C(O)C(O)C1O
InChI Identifier
InChI=1S/C12H23O14P/c13-1-3-5(14)7(16)9(18)11(24-3)26-12-10(19)8(17)6(15)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)
InChI KeyLABSPYBHMPDTEL-UHFFFAOYSA-N