Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 18:39:57 UTC
Update Date2022-08-31 06:17:25 UTC
Metabolite IDMMDBc0000967
Metabolite Identification
Common NamePenicillither
Description
Structure
SynonymsNot Available
Molecular FormulaC18H17ClO8
Average Mass396.78
Monoisotopic Mass396.0611952
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C18H17ClO8/c1-8-5-11(21)13(18(23)26-4)16(14(8)19)27-15-10(17(22)25-3)6-9(20)7-12(15)24-2/h5-7,20-21H,1-4H3
InChI KeyDLXJKSNQVHUUOT-UHFFFAOYSA-N