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D-arabino-D-gluco-L-ido-Pentadecitol, 2,4,7,8,10,14,15-heptadeoxy-2,4,8,10-tetramethyl-6,12-di-C-methyl-1,3:11,12-bis-O-(1-methylethylidene)-
SpectraBase Compound ID HgB27fI8PsJ
InChI InChI=1S/C27H52O8/c1-12-19(28)27(11)23(34-25(8,9)35-27)17(4)20(29)15(2)13-26(10,31)22(30)18(5)21-16(3)14-32-24(6,7)33-21/h15-23,28-31H,12-14H2,1-11H3/t15-,16+,17+,18+,19-,20+,21-,22-,23-,26-,27-/m1/s1
InChIKey GKLPSYZQMMZOCM-WKGGFQCQSA-N
Mol Weight 504.7 g/mol
Molecular Formula C27H52O8
Exact Mass 504.366219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4R3H20F5l64
Name D-arabino-D-gluco-L-ido-Pentadecitol, 2,4,7,8,10,14,15-heptadeoxy-2,4,8,10-tetramethyl-6,12-di-C-methyl-1,3:11,12-bis-O-(1-methylethylidene)-
Alternate Name(s) (2R,3R,4R,6R,7S,8S)-8-[(4R,5R)-5-[(1R)-1-hydroxypropyl]-2,2,5-trimethyl-1,3-dioxolan-4-yl]-4,6-dimethyl-2-[(4R,5S)-2,2,5-trimethyl-1,3-dioxan-4-yl]nonane-3,4,7-triol (2S,3R,4R,5R,6R,8R,9S,10S,11R,12R,13R)-5,6,9,13-tetrahydroxy-1,3:11,12-bis(isopropylidenedioxy)-2,4,6,8,10,12-hexamethylpentadecane
CAS Registry Number 96916-74-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H52O8
InChI InChI=1S/C27H52O8/c1-12-19(28)27(11)23(34-25(8,9)35-27)17(4)20(29)15(2)13-26(10,31)22(30)18(5)21-16(3)14-32-24(6,7)33-21/h15-23,28-31H,12-14H2,1-11H3/t15-,16+,17+,18+,19-,20+,21-,22-,23-,26-,27-/m1/s1
InChIKey GKLPSYZQMMZOCM-WKGGFQCQSA-N
Molecular Weight 504.705 g/mol
SMILES O[C@@]([C@@](C[C@]([C@@]([C@@]([C@@]1([C@](OC(C)(C)O1)([C@](O)(CC)[H])C)[H])(C)[H])(O)[H])(C)[H])(O)C)([C@]([C@@]1(OC(C)(C)OC[C@@]1(C)[H])[H])(C)[H])[H]
SPLASH splash10-052f-9020000000-5f999ae36958e1f764b8
Source of Spectrum KC-1985-32-23
Wiley ID 1399561