SpectraBase Compound ID | 8XxwDdtfqRV |
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InChI | InChI=1S/C39H48O6/c1-26(16-17-34-28(3)21-32(43-29(4)40)23-36(34,5)6)14-12-10-11-13-15-27(2)20-31-22-30(35(41)44-31)18-19-39-37(7,8)24-33(45-39)25-38(39,9)42/h10-15,18-20,22,32-33,42H,21,23-25H2,1-9H3/b12-10+,13-11+,19-18+,26-14+,27-15+,31-20-/t32-,33+,38-,39-/m1/s1 |
InChIKey | GRBTZPLUNSWVPO-YOZNXODWSA-N |
Mol Weight | 612.8 g/mol |
Molecular Formula | C39H48O6 |
Exact Mass | 612.345089 g/mol |
SpectraBase Spectrum ID | AqupdWoWPVu |
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Name | CYCLOPYRRHOXANTHIN |
Compound Number | 5 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C39H48O6 |
InChI | InChI=1S/C39H48O6/c1-26(16-17-34-28(3)21-32(43-29(4)40)23-36(34,5)6)14-12-10-11-13-15-27(2)20-31-22-30(35(41)44-31)18-19-39-37(7,8)24-33(45-39)25-38(39,9)42/h10-15,18-20,22,32-33,42H,21,23-25H2,1-9H3/b12-10+,13-11+,19-18+,26-14+,27-15+,31-20-/t32-,33+,38-,39-/m1/s1 |
InChIKey | GRBTZPLUNSWVPO-YOZNXODWSA-N |
Literature Reference Author | T.MAOKA,Y.FUJIWARA,K.HASHIMOTO,N.AKIMOTO |
Literature Reference Citation | J.NAT.PROD.,68,1341(2005) |
Literature Reference DOI | 10.1021/np058053n |
Molecular Weight | 612.807 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMZ13384 |