![CYCLO-[-MEBMT-(1)-ABU-(2)-SAR-(3)-MELEU-(4)-VAL-(5)-MELEU-(6)-ALA-(7)-D-ALA-(8)-MELEU-(9)-MENVA-(10)-MEVAL-(11)-]](/api/spectrum/1bsRSXVNtGf/structure.png?h=300&w=458 "CYCLO-[-MEBMT-(1)-ABU-(2)-SAR-(3)-MELEU-(4)-VAL-(5)-MELEU-(6)-ALA-(7)-D-ALA-(8)-MELEU-(9)-MENVA-(10)-MEVAL-(11)-]")
| SpectraBase Compound ID | 8k896S3SUB8 |
|---|---|
| InChI | InChI=1S/C61H109N11O12/c1-24-27-29-39(14)51(74)50-55(78)64-42(26-3)57(80)66(17)33-47(73)67(18)44(30-34(4)5)54(77)65-48(37(10)11)60(83)69(20)45(31-35(6)7)53(76)62-40(15)52(75)63-41(16)56(79)70(21)46(32-36(8)9)59(82)68(19)43(28-25-2)58(81)71(22)49(38(12)13)61(84)72(50)23/h24,27,34-46,48-51,74H,25-26,28-33H2,1-23H3,(H,62,76)(H,63,75)(H,64,78)(H,65,77)/b27-24+ |
| InChIKey | WKXVYCGLVFPFIG-SOYKGTTHSA-N |
| Mol Weight | 1188.6 g/mol |
| Molecular Formula | C61H109N11O12 |
| Exact Mass | 1187.825718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1bsRSXVNtGf |
|---|---|
| Name | CYCLO-[-MEBMT-(1)-ABU-(2)-SAR-(3)-MELEU-(4)-VAL-(5)-MELEU-(6)-ALA-(7)-D-ALA-(8)-MELEU-(9)-MENVA-(10)-MEVAL-(11)-] |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H109N11O12 |
| InChI | InChI=1S/C61H109N11O12/c1-24-27-29-39(14)51(74)50-55(78)64-42(26-3)57(80)66(17)33-47(73)67(18)44(30-34(4)5)54(77)65-48(37(10)11)60(83)69(20)45(31-35(6)7)53(76)62-40(15)52(75)63-41(16)56(79)70(21)46(32-36(8)9)59(82)68(19)43(28-25-2)58(81)71(22)49(38(12)13)61(84)72(50)23/h24,27,34-46,48-51,74H,25-26,28-33H2,1-23H3,(H,62,76)(H,63,75)(H,64,78)(H,65,77)/b27-24+ |
| InChIKey | WKXVYCGLVFPFIG-SOYKGTTHSA-N |
| Literature Reference Author | M.KUZMA,P.SEDMERA,A.JEGOROV,V.HAVLICEK |
| Literature Reference Citation | J.NAT.PROD.,72,159(2009) |
| Literature Reference DOI | 10.1021/np8003968 |
| Molecular Weight | 1188.603 g/mol |
| Sample ID | 32077 |
| Solvent | CDCl3 |