John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9ABK1QSvqdJ

(accessed ).
PHAKELLISTATIN-2;LESS-POLAR-CONFORMER
SpectraBase Compound ID 9ABK1QSvqdJ
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-UZPVMMMDSA-N
Mol Weight 828.0 g/mol
Molecular Formula C45H61N7O8
Exact Mass 827.458162 g/mol
Enantiomer InChIKey LNXDZKNDLBCPBR-IGOBNWLLSA-N
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
  • PHAKELLISTATIN-2;SYNTHETIC-COMPOUND
  • PHAKELLISTATIN-2;ORIGINAL-ISOLATE
  • PHAKELLISTATIN-2;MORE-POLAR-CONFORMER
Title Journal or Book Year
Two Distinct Conformers of the Cyclic Heptapeptide Phakellistatin 2 Isolated from the Fijian Marine SpongeStylotellaaurantium The Journal of Organic Chemistry 2002
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