SpectraBase Compound ID | A2tPrdUBLyK |
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InChI | InChI=1S/C38H60N6O6/c1-9-25(8)32-37(49)41-28(19-23(4)5)34(46)42-30(21-26-14-11-10-12-15-26)38(50)44-17-13-16-31(44)36(48)40-27(18-22(2)3)33(45)39-29(20-24(6)7)35(47)43-32/h10-12,14-15,22-25,27-32H,9,13,16-21H2,1-8H3,(H,39,45)(H,40,48)(H,41,49)(H,42,46)(H,43,47)/t25?,27-,28-,29+,30+,31-,32-/m0/s1 |
InChIKey | AKQUYKYHJPCGHJ-FUFNLKBZSA-N |
Mol Weight | 696.9 g/mol |
Molecular Formula | C38H60N6O6 |
Exact Mass | 696.457434 g/mol |
SpectraBase Spectrum ID | Kxb5oGuNQLx |
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Name | PHEPROPEPTIN-C;CYCLO-(-L-LEU-D-PHE-L-PRO-L-LEU-D-LEU-L-ISOLEU-) |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C38H60N6O6 |
InChI | InChI=1S/C38H60N6O6/c1-9-25(8)32-37(49)41-28(19-23(4)5)34(46)42-30(21-26-14-11-10-12-15-26)38(50)44-17-13-16-31(44)36(48)40-27(18-22(2)3)33(45)39-29(20-24(6)7)35(47)43-32/h10-12,14-15,22-25,27-32H,9,13,16-21H2,1-8H3,(H,39,45)(H,40,48)(H,41,49)(H,42,46)(H,43,47)/t25?,27-,28-,29+,30+,31-,32-/m0/s1 |
InChIKey | AKQUYKYHJPCGHJ-FUFNLKBZSA-N |
Literature Reference Author | R.SEKIZAWA,I.MOMOSE,N.KINOSHITA,H.NAGANAWA,M.HAMADA,Y.MURAOK A,H.IINUMA,T.TAKEUCH |
Literature Reference Citation | J.ANTIBIOTICS,54,874(2001) |
Literature Reference DOI | 10.7164/antibiotics.54.874 |
Molecular Weight | 696.931 g/mol |
Solvent | CDCl3 |