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PHAKELLISTATIN-2;CYCLO-(TYR-PRO-PHE-PRO-ILE-ILE-PRO)
SpectraBase Compound ID dmO1KQb3nZ
InChI InChI=1S/C45H61N7O8/c1-5-27(3)37-42(57)49-38(28(4)6-2)45(60)52-24-12-16-35(52)40(55)47-33(26-30-18-20-31(53)21-19-30)44(59)50-22-10-15-34(50)39(54)46-32(25-29-13-8-7-9-14-29)43(58)51-23-11-17-36(51)41(56)48-37/h7-9,13-14,18-21,27-28,32-38,53H,5-6,10-12,15-17,22-26H2,1-4H3,(H,46,54)(H,47,55)(H,48,56)(H,49,57)/t27?,28?,32-,33-,34-,35-,36-,37-,38-/m0/s1
InChIKey LNXDZKNDLBCPBR-IPBAVMDASA-N
Mol Weight 828.0 g/mol
Molecular Formula C45H61N7O8
Exact Mass 827.458162 g/mol
Enantiomer InChIKey LNXDZKNDLBCPBR-QKQUJBIXSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Title Journal or Book Year
Antineoplastic Agents. 400. Synthesis of the Indian Ocean Marine Sponge Cyclic Heptapeptide Phakellistatin 2,1a Journal of Natural Products 1999

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