Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 04:39:22 UTC
Update Date2022-08-31 06:35:57 UTC
MiMeDB IDMMDBc0013332
Metabolite Identification
Common NamePlusbacin B1
Description
Structure
SynonymsNot Available
Chemical FormulaC48H79N11O19
Average Molecular Weight1114.218
Monoisotopic Molecular Weight1113.555369368
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C48H79N11O19/c1-4-5-6-7-8-9-10-11-12-15-26-22-31(63)55-32(25(3)61)40(68)52-24(2)43(71)58-20-14-17-29(58)39(67)53-27(16-13-19-51-48(49)50)38(66)56-33(36(64)45(73)74)41(69)54-28(23-60)44(72)59-21-18-30(62)35(59)42(70)57-34(47(77)78-26)37(65)46(75)76/h24-30,32-37,60-62,64-65H,4-23H2,1-3H3,(H,52,68)(H,53,67)(H,54,69)(H,55,63)(H,56,66)(H,57,70)(H,73,74)(H,75,76)(H4,49,50,51)
InChI KeyPEBYLDKPVXXCJK-UHFFFAOYSA-N