(2' R)-2-[4''-(.beta.-D-Glucopyranosyloxy)-3''-methylbut-2''-enyl]-2'-(4"'-hydroxy-3"'-methylbut-2''-enyl)-.beta.,.beta.-carotene

SpectraBase Compound ID	BNvc3Y5F9Yj
InChI	InChI=1S/C56H82O7/c1-38(19-15-21-40(3)25-33-48-44(7)27-31-46(55(48,9)10)29-23-42(5)35-57)17-13-14-18-39(2)20-16-22-41(4)26-34-49-45(8)28-32-47(56(49,11)12)30-24-43(6)37-62-54-53(61)52(60)51(59)50(36-58)63-54/h13-26,33-34,46-47,50-54,57-61H,27-32,35-37H2,1-12H3/b14-13+,19-15+,20-16+,33-25+,34-26+,38-17+,39-18+,40-21+,41-22+,42-23+,43-24+/t46?,47?,50-,51?,52+,53-,54-/m1/s1
InChIKey	UCVXTUCEDYVMOY-ZDNQQMBFSA-N Google Search
Mol Weight	867.3 g/mol
Molecular Formula	C56H82O7
Exact Mass	866.606055 g/mol

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SpectraBase Spectrum ID	5MwLUHEkRRJ
Name	(2' R)-2-[4''-(.beta.-D-Glucopyranosyloxy)-3''-methylbut-2''-enyl]-2'-(4"'-hydroxy-3"'-methylbut-2''-enyl)-.beta.,.beta.-carotene
Alternate Name(s)	(2' R)-2-[4''-(.beta.-D-Glucopyranosyloxy)-3''-methylbut-2''-enyl]-2'-(4'''-hydroxy-3'''-methylbut-2''-enyl)-.beta.,.beta.-carotene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C56H82O7
InChI	InChI=1S/C56H82O7/c1-38(19-15-21-40(3)25-33-48-44(7)27-31-46(55(48,9)10)29-23-42(5)35-57)17-13-14-18-39(2)20-16-22-41(4)26-34-49-45(8)28-32-47(56(49,11)12)30-24-43(6)37-62-54-53(61)52(60)51(59)50(36-58)63-54/h13-26,33-34,46-47,50-54,57-61H,27-32,35-37H2,1-12H3/b14-13+,19-15+,20-16+,33-25+,34-26+,38-17+,39-18+,40-21+,41-22+,42-23+,43-24+/t46?,47?,50-,51?,52+,53-,54-/m1/s1
InChIKey	UCVXTUCEDYVMOY-ZDNQQMBFSA-N
Molecular Weight	867.265 g/mol
SMILES	O[C@]1(C([C@](O[C@]([C@@]1(O)[H])(OC\C(=C\CC1C(C(\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C=2C(C(C\C=C\(CO)C)CCC2C)(C)C)C)C)C)C)=C(CC1)C)(C)C)C)[H])(CO)[H])O)[H]
SPLASH	splash10-0arc-9542010000-32e058cdba46ef572310
Source of Spectrum	H-83-334-4
Wiley ID	846976