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PETRATETRAYNDIOL_C
SpectraBase Compound ID AyKvg4dHP9J
InChI InChI=1S/C46H68O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-19-25-30-35-40-45(48)41-36-31-26-20-17-18-21-27-32-37-42-46(49)43-38-33-28-23-22-24-29-34-39-44(47)4-2/h1-2,5-6,17,20,34-35,39-40,44,46-47,49H,7-16,18-19,21-33,36,41H2/b6-5-,20-17-,39-34+,40-35+/t44-,46-/m0/s1
InChIKey NDHYGFMCXMXPOB-SAJPTYQYSA-N
Mol Weight 669.0 g/mol
Molecular Formula C46H68O3
Exact Mass 668.516846 g/mol
Enantiomer InChIKey NDHYGFMCXMXPOB-QHFKMOKLSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Title Journal or Book Year
New Cytotoxic Polyacetylenes from the Marine Sponge Petrosia Journal of Natural Products 1999

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