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.alpha.-D-Glucopyranose, 6-(9,12,15-octadecatrienoate), (Z,Z,Z)-
SpectraBase Compound ID BMhiBv3R0BS
InChI InChI=1S/C24H40O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25)30-18-19-21(26)22(27)23(28)24(29)31-19/h3-4,6-7,9-10,19,21-24,26-29H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-/t19-,21-,22+,23-,24+/m1/s1
InChIKey NQUMXKFHKAGTAM-JXTHESEHSA-N
Mol Weight 440.6 g/mol
Molecular Formula C24H40O7
Exact Mass 440.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mNMBO50pt4
Name .alpha.-D-Glucopyranose, 6-(9,12,15-octadecatrienoate), (Z,Z,Z)-
CAS Registry Number 68727-55-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H40O7
InChI InChI=1S/C24H40O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25)30-18-19-21(26)22(27)23(28)24(29)31-19/h3-4,6-7,9-10,19,21-24,26-29H,2,5,8,11-18H2,1H3/b4-3-,7-6-,10-9-/t19-,21-,22+,23-,24+/m1/s1
InChIKey NQUMXKFHKAGTAM-JXTHESEHSA-N
Molecular Weight 440.577 g/mol
SMILES O[C@@]1([C@](O[C@@]([C@@]([C@]1(O)[H])(O)[H])(O)[H])(COC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC)[H])[H]
SPLASH splash10-0udi-0290000000-103ed039cea493df183d
Source of Spectrum W5-35163-30373-30373
Synonyms 6-O-[(9Z,12Z,15Z)-9,12,15-octadecatrienoyl]-.alpha.-D-glucopyranose
Wiley ID 1384699