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LONGITHORONE_A
SpectraBase Compound ID 6YiUUTSq5CC
InChI InChI=1S/C42H46O5/c1-25-6-4-8-28-15-33(14-27(3)10-11-30-19-38(45)31(12-25)20-37(30)44)41(24-43)22-35-17-29-9-5-7-26(2)13-32-21-39(46)42(35,23-34(41)16-28)36(18-29)40(32)47/h6-7,10,15,17,19-21,24,33-36H,4-5,8-9,11-14,16,18,22-23H2,1-3H3/b25-6-,26-7-,27-10+/t33-,34+,35+,36?,41-,42-/m1/s1
InChIKey XAOPIXYTATVACB-FEPFFMPBSA-N
Mol Weight 630.8 g/mol
Molecular Formula C42H46O5
Exact Mass 630.334525 g/mol
Enantiomer InChIKey XAOPIXYTATVACB-LSXHDEFJSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D6
Title Journal or Book Year
Longithorones, Unique Prenylated Para- and Metacyclophane Type Quinones from the Tunicate Aplidium longithorax The Journal of Organic Chemistry 1997

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