For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Glycocitrine-III

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Glycocitrine-III
SpectraBase Compound ID 74aRruVBSHk
InChI InChI=1S/C24H27NO4/c1-14(2)7-5-8-15(3)11-12-16-20(27)13-18-21(23(16)28)24(29)17-9-6-10-19(26)22(17)25(18)4/h6-7,9-11,13,26-28H,5,8,12H2,1-4H3/b15-11+
InChIKey FAGMTKNQSPGJIT-RVDMUPIBSA-N
Mol Weight 393.48 g/mol
Molecular Formula C24H27NO4
Exact Mass 393.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JoI9djr73n6
Name Glycocitrine-III
Alternate Name(s) 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxy-10-methyl-9-acridinone 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxy-10-methylacridin-9-one 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-10-methyl-1,3,5-tris(oxidanyl)acridin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO4
InChI InChI=1S/C24H27NO4/c1-14(2)7-5-8-15(3)11-12-16-20(27)13-18-21(23(16)28)24(29)17-9-6-10-19(26)22(17)25(18)4/h6-7,9-11,13,26-28H,5,8,12H2,1-4H3/b15-11+
InChIKey FAGMTKNQSPGJIT-RVDMUPIBSA-N
Molecular Weight 393.483 g/mol
SMILES Oc1cccc2c1N(c1c(c(c(c(c1)O)C\C=C\(CCC=C(C)C)C)O)C2=O)C
SPLASH splash10-00di-0089000000-822f01fcbeb0ede8988d
Source of Spectrum E2-47-1581-2
Wiley ID 1554974