Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 23:23:33 UTC
Update Date2022-08-31 06:24:45 UTC
Metabolite IDMMDBc0006001
Metabolite Identification
Common NamePGL K6
Description
Structure
SynonymsNot Available
Molecular FormulaC61H104O21
Average Mass1173.482
Monoisotopic Mass1172.707010369
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C61H104O21/c1-17-22-34(5)57(65)77-42(25-21-20-24-33(4)45(19-3)67-11)31-43(78-58(66)35(6)23-18-2)30-40-26-28-41(29-27-40)79-59-56(72-16)53(50(69-13)39(10)76-59)82-61-55(71-15)52(48(64)37(8)75-61)81-60-54(70-14)51(47(63)36(7)74-60)80-46-32-44(62)49(68-12)38(9)73-46/h26-29,33-39,42-56,59-64H,17-25,30-32H2,1-16H3/t33?,34?,35?,36?,37?,38?,39?,42?,43?,44?,45?,46-,47-,48+,49+,50+,51?,52?,53?,54?,55?,56?,59+,60+,61+/m0/s1
InChI KeyBAURFOKBHKXORK-NWZWPWFOSA-N