| SpectraBase Compound ID | 3O3XYGh4P2l |
|---|---|
| InChI | InChI=1S/C50H72N4O17/c1-29(18-19-40(71-50(62)43(66-11)27-63-8)33(5)46(69-34(6)56)30(2)20-21-54(7)28-55)41(65-10)24-42-32(4)39(64-9)16-13-17-44-51-38(26-67-44)49-52-37(25-68-49)48(61)53-47(60)31(3)22-35(57)14-12-15-36(58)23-45(59)70-42/h12-14,17,20-21,25-26,28-33,36,39-43,46,58H,15-16,18-19,22-24,27H2,1-11H3,(H,53,60,61)/b14-12+,17-13+,21-20+ |
| InChIKey | RMIFGCVKTYZXIP-JXFAGSJASA-N |
| Mol Weight | 1001.1 g/mol |
| Molecular Formula | C50H72N4O17 |
| Exact Mass | 1000.489247 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EAJ8wzpMITc |
|---|---|
| Name | MYCALOLIDE-D;MINOR-(Z) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H72N4O17 |
| InChI | InChI=1S/C50H72N4O17/c1-29(18-19-40(71-50(62)43(66-11)27-63-8)33(5)46(69-34(6)56)30(2)20-21-54(7)28-55)41(65-10)24-42-32(4)39(64-9)16-13-17-44-51-38(26-67-44)49-52-37(25-68-49)48(61)53-47(60)31(3)22-35(57)14-12-15-36(58)23-45(59)70-42/h12-14,17,20-21,25-26,28-33,36,39-43,46,58H,15-16,18-19,22-24,27H2,1-11H3,(H,53,60,61)/b14-12+,17-13+,21-20+ |
| InChIKey | RMIFGCVKTYZXIP-JXFAGSJASA-N |
| Literature Reference Author | M.A.RASHID,K.R.GUSTAFSON,J.H.CARDELLINA,M.R.BOYD |
| Literature Reference Citation | J.NAT.PROD.,58,1120(1995) |
| Literature Reference DOI | 10.1021/np50121a025 |
| Molecular Weight | 1001.138 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP6668 |