[MELEU(1)]-CYCLOSPORIN-A;CYLOSPORIN-J;CYCLO-[-MELEU(1)-ABU(2)-SAR(3)-MELEU(4)-VAL(5)-MELEU(6)-ALA(7)-D-ALA(8)-MELEU(9)-MELEU(10)-MEVAL(11)-]

SpectraBase Compound ID	3p3UiXppoD7
InChI	InChI=1S/C59H107N11O11/c1-25-41-55(77)64(18)31-47(71)65(19)42(26-32(2)3)53(75)63-48(37(12)13)58(80)66(20)43(27-33(4)5)51(73)60-39(16)50(72)61-40(17)54(76)68(22)45(29-35(8)9)56(78)69(23)46(30-36(10)11)57(79)70(24)49(38(14)15)59(81)67(21)44(28-34(6)7)52(74)62-41/h32-46,48-49H,25-31H2,1-24H3,(H,60,73)(H,61,72)(H,62,74)(H,63,75)/t39-,40-,41-,42-,43-,44-,45-,46-,48-,49-/m1/s1
InChIKey	JFJHGNWTEKJXNK-GZSRDYPLSA-N Google Search
Mol Weight	1146.6 g/mol
Molecular Formula	C59H107N11O11
Exact Mass	1145.815153 g/mol

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SpectraBase Spectrum ID	7oiDmPdM2Ms
Name	[MELEU(1)]-CYCLOSPORIN-A;CYLOSPORIN-J;CYCLO-[-MELEU(1)-ABU(2)-SAR(3)-MELEU(4)-VAL(5)-MELEU(6)-ALA(7)-D-ALA(8)-MELEU(9)-MELEU(10)-MEVAL(11)-]
Compound Number	2
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C59H107N11O11
InChI	InChI=1S/C59H107N11O11/c1-25-41-55(77)64(18)31-47(71)65(19)42(26-32(2)3)53(75)63-48(37(12)13)58(80)66(20)43(27-33(4)5)51(73)60-39(16)50(72)61-40(17)54(76)68(22)45(29-35(8)9)56(78)69(23)46(30-36(10)11)57(79)70(24)49(38(14)15)59(81)67(21)44(28-34(6)7)52(74)62-41/h32-46,48-49H,25-31H2,1-24H3,(H,60,73)(H,61,72)(H,62,74)(H,63,75)/t39-,40-,41-,42-,43-,44-,45-,46-,48-,49-/m1/s1
InChIKey	JFJHGNWTEKJXNK-GZSRDYPLSA-N
Literature Reference Author	A.JEGOROV,V.MATHA,P.SEDMERA,V.HAVLICEK,J.STUCHLIK,P.SEIDEL,P .SIMEK
Literature Reference Citation	PHYTOCHEM.,38,403(1995)
Literature Reference DOI	10.1016/0031-9422(94)00711-2
Molecular Weight	1146.566 g/mol
Solvent	Unknown
Source File Reference	UWMS4737