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Dendroidinic acid
SpectraBase Compound ID LOcbRvGmZwk
InChI InChI=1S/C25H38O4/c1-8-17(3)23(28)29-19-14-24(5,6)21-12-10-18(4)20(25(21,7)15-19)11-9-16(2)13-22(26)27/h8,10,13,19-21H,9,11-12,14-15H2,1-7H3,(H,26,27)/b16-13-,17-8-/t19-,20-,21-,25+/m1/s1
InChIKey LEMSFGHOXFQURQ-GLBIYOOKSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MYqgQlvcT9
Name Dendroidinic acid
CAS Registry Number 63147-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-8-17(3)23(28)29-19-14-24(5,6)21-12-10-18(4)20(25(21,7)15-19)11-9-16(2)13-22(26)27/h8,10,13,19-21H,9,11-12,14-15H2,1-7H3,(H,26,27)/b16-13-,17-8-/t19-,20-,21-,25+/m1/s1
InChIKey LEMSFGHOXFQURQ-GLBIYOOKSA-N
Molecular Weight 402.575 g/mol
SMILES OC(\C=C/(CC[C@]1([C@]2([C@@](C(C)(C)C[C@@](OC(\C(=C/C)C)=O)(C2)[H])(CC=C1C)[H])C)[H])C)=O
SPLASH splash10-0pc0-9030000000-c1509854e17e8be3f89d
Source of Spectrum K-110-1328-0
Wiley ID 1370558