(3S,4R,5R)-3-[(7E)-Hexadec-7-en-1-yl]-4,5-dihydro-4-hydroxy-5-methylfuran-2(3H)-one

SpectraBase Compound ID	A5ZYlU7j5aN
InChI	InChI=1S/C21H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h10-11,18-20,22H,3-9,12-17H2,1-2H3/b11-10+/t18-,19+,20+/m1/s1
InChIKey	BRHQPRAQLMOAKC-SGEJMCJESA-N Google Search
Mol Weight	338.5 g/mol
Molecular Formula	C21H38O3
Exact Mass	338.282095 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	A4KydRKIX8P
Name	(3S,4R,5R)-3-[(7E)-Hexadec-7-en-1-yl]-4,5-dihydro-4-hydroxy-5-methylfuran-2(3H)-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H38O3
InChI	InChI=1S/C21H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h10-11,18-20,22H,3-9,12-17H2,1-2H3/b11-10+/t18-,19+,20+/m1/s1
InChIKey	BRHQPRAQLMOAKC-SGEJMCJESA-N
Literature Reference DOI	10.1002/cbdv.200790137
Molecular Weight	338.532 g/mol
SMILES	O[C@@]1([C@@](C(O[C@@]1(C)[H])=O)(CCCCCC\C=C\CCCCCCCC)[H])[H]
SPLASH	splash10-014i-2921000000-cdf980a237d10c2c6265
Source of Spectrum	CBD-4-1584-2
Synonyms	Calligonolide B (3S,4R,5R)-3-((E)-hexadec-7-en-1-yl)-4-hydroxy-5-methyldihydrofuran-2(3H)-one
Wiley ID	1790348