| SpectraBase Compound ID | 5e8Nq8B1Eb6 |
|---|---|
| InChI | InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42+,43-,44+,45-,46+,47+,49+,50-,51+,52-/m1/s1 |
| InChIKey | PMATZTZNYRCHOR-VJRYSDSKSA-N |
| Mol Weight | 1202.6 g/mol |
| Molecular Formula | C62H111N11O12 |
| Exact Mass | 1201.841368 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bdd2PS0GlWO |
|---|---|
| Name | CYCLOSPORIN-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H111N11O12 |
| InChI | InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42+,43-,44+,45-,46+,47+,49+,50-,51+,52-/m1/s1 |
| InChIKey | PMATZTZNYRCHOR-VJRYSDSKSA-N |
| Literature Reference Author | A.A.PATCHETT,D.TAUB,O.D.HENSENS,R.T.GOEGELMAN,L.YANG,F.DUMON T,L.PETERSON,N.H.SIG |
| Literature Reference Citation | J.ANTIBIOTICS,45,94(1992) |
| Literature Reference DOI | 10.7164/antibiotics.45.94 |
| Molecular Weight | 1202.630 g/mol |
| Sample ID | 45809 |
| Solvent | C6D6 |