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14-[2'-Hydroxy-3',4'-dimethyl-5'-(1"-.beta.-L-xylopyranyloxy)phenyl]-4,8,12-trimethyltetradeca-4,8,12-trienoic acid
SpectraBase Compound ID 4CnrFyBrNmd
InChI InChI=1S/C30H44O8/c1-18(9-7-11-20(3)13-15-26(32)33)8-6-10-19(2)12-14-23-16-25(21(4)22(5)27(23)34)38-30-29(36)28(35)24(31)17-37-30/h8,11-12,16,24,28-31,34-36H,6-7,9-10,13-15,17H2,1-5H3,(H,32,33)/b18-8+,19-12+,20-11+/t24-,28+,29-,30-/m1/s1
InChIKey BHNJFIZZQGJJRA-XQZSHBFSSA-N
Mol Weight 532.7 g/mol
Molecular Formula C30H44O8
Exact Mass 532.303618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hXxbsLf8K
Name 14-[2'-Hydroxy-3',4'-dimethyl-5'-(1"-.beta.-L-xylopyranyloxy)phenyl]-4,8,12-trimethyltetradeca-4,8,12-trienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44O8
InChI InChI=1S/C30H44O8/c1-18(9-7-11-20(3)13-15-26(32)33)8-6-10-19(2)12-14-23-16-25(21(4)22(5)27(23)34)38-30-29(36)28(35)24(31)17-37-30/h8,11-12,16,24,28-31,34-36H,6-7,9-10,13-15,17H2,1-5H3,(H,32,33)/b18-8+,19-12+,20-11+/t24-,28+,29-,30-/m1/s1
InChIKey BHNJFIZZQGJJRA-XQZSHBFSSA-N
Molecular Weight 532.674 g/mol
SMILES OC(CC\C(=C\CC\C(=C\CC\C(=C\Cc1c(c(c(c(O[C@@]2([C@@]([C@]([C@@](CO2)(O)[H])(O)[H])(O)[H])[H])c1)C)C)O)C)C)C)=O
SPLASH splash10-0udr-1900300000-a270c5637cb079af2a36
Source of Spectrum U-1997-1083-1
Wiley ID 769725