SpectraBase Spectrum ID |
5Mn19MUP1pM |
Name |
Oct-2-enonic acid, 2,3,5-trideoxy-2-methyl-6-C-methyl-8-O-(7-oxo-7H-furo[3,2-g][1]benzopyran-9-yl)-, .gamma.-lactone |
CAS Registry Number |
68729-09-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H20O8 |
InChI |
InChI=1S/C21H20O8/c1-11-7-14(28-20(11)24)9-21(2,25)15(22)10-27-19-17-13(5-6-26-17)8-12-3-4-16(23)29-18(12)19/h3-8,14-15,22,25H,9-10H2,1-2H3 |
InChIKey |
AJEDMWQPEGCRLJ-UHFFFAOYSA-N |
Molecular Weight |
400.383 g/mol |
SMILES |
OC(C(COc1c2OC(=O)C=Cc2cc2c1occ2)O)(CC1OC(=O)C(=C1)C)C |
SPLASH |
splash10-0ufr-9150000000-f7c53368cb0bd0580b01 |
Source of Spectrum |
W5-33561-31975-31975 |
Synonyms |
5-[2,3-dihydroxy-2-methyl-4-({2-oxo-2H-furo[3,2-g]chromen-9-yl}oxy)butyl]-3-methyl-2,5-dihydrofuran-2-one |
Wiley ID |
1369323 |