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Anaphalisoic acid [5,9,13-trimethyleicos-5-en-17,18-diol-24-oic acid]
SpectraBase Compound ID 55DtQDCJ6Ua
InChI InChI=1S/C24H46O4/c1-6-8-12-19(3)13-9-14-20(4)15-10-16-21(5)17-11-18-24(28,23(26)27)22(25)7-2/h13,20-22,25,28H,6-12,14-18H2,1-5H3,(H,26,27)/b19-13+/t20-,21-,22?,24?/m1/s1
InChIKey DCWNUBAPCWIKSO-XMZXFDISSA-N
Mol Weight 398.6 g/mol
Molecular Formula C24H46O4
Exact Mass 398.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SHZi23rVzd
Name Anaphalisoic acid [5,9,13-trimethyleicos-5-en-17,18-diol-24-oic acid]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H46O4
InChI InChI=1S/C24H46O4/c1-6-8-12-19(3)13-9-14-20(4)15-10-16-21(5)17-11-18-24(28,23(26)27)22(25)7-2/h13,20-22,25,28H,6-12,14-18H2,1-5H3,(H,26,27)/b19-13+/t20-,21-,22?,24?/m1/s1
InChIKey DCWNUBAPCWIKSO-XMZXFDISSA-N
Molecular Weight 398.628 g/mol
SMILES OC(C(C(O)=O)(O)CCC[C@@](CCC[C@@](CC\C=C\(CCCC)C)(C)[H])(C)[H])CC
SPLASH splash10-0a59-9101000000-7ad2fd070f8f804f8980
Source of Spectrum Y1-42B-4-2
Synonyms Anaphalisoic acid (6R,10S,E)-2-hydroxy-2-(1-hydroxypropyl)-6,10,14-trimethyloctadec-13-enoic acid
Wiley ID 1744188