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AMPHIDINOLODE-T1
SpectraBase Compound ID KU5AbLS5s4z
InChI InChI=1S/C25H42O5/c1-6-9-20-13-16(2)12-19(5)24(27)22(26)15-21-14-18(4)23(29-21)11-8-7-10-17(3)25(28)30-20/h17-21,23-24,27H,2,6-15H2,1,3-5H3/t17-,18-,19+,20+,21+,23-,24-/m0/s1
InChIKey FZJIYZVNIQNZGS-DMPLHEPCSA-N
Mol Weight 422.6 g/mol
Molecular Formula C25H42O5
Exact Mass 422.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BY5Io9X7Dke
Name Amphidinolide T1
Alternate Name(s) (1S,6S,9R,13R,14S,17R,19S)-14-hydroxy-6,13,19-trimethyl-11-methylene-9-propyl-8,20-dioxabicyclo[15.2.1]icosane-7,15-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O5
InChI InChI=1S/C25H42O5/c1-6-9-20-13-16(2)12-19(5)24(27)22(26)15-21-14-18(4)23(29-21)11-8-7-10-17(3)25(28)30-20/h17-21,23-24,27H,2,6-15H2,1,3-5H3/t17-,18-,19+,20+,21+,23-,24-/m0/s1
InChIKey FZJIYZVNIQNZGS-DMPLHEPCSA-N
Molecular Weight 422.606 g/mol
SMILES O[C@]1([C@@](CC(C[C@@](CCC)(OC(=O)[C@@](C)(CCCC[C@@]2(O[C@](C[C@@]2(C)[H])(CC1=O)[H])[H])[H])[H])=C)(C)[H])[H]
SPLASH splash10-00di-0396000000-d6934cd5e29b50d30562
Source of Spectrum ACI-52-SM21-1
Wiley ID 1781849