| SpectraBase Compound ID | FyC4E9Wdn8G |
|---|---|
| InChI | InChI=1S/C50H80N8O12/c1-17-29(7)41-46(65)52-25-38(59)56(13)36(23-27(3)4)44(63)51-26-39(60)58(15)40(28(5)6)47(66)57(14)37(24-33-19-21-34(69-16)22-20-33)45(64)53-31(9)42(61)50(11,12)49(68)54-32(10)43(62)55-35(18-2)30(8)48(67)70-41/h19-22,27-32,35-37,40-41H,17-18,23-26H2,1-16H3,(H,51,63)(H,52,65)(H,53,64)(H,54,68)(H,55,62)/t29-,30-,31-,32-,35+,36-,37-,40-,41-/m0/s1 |
| InChIKey | XOSLDLHSPLPVME-FKLVWXFWSA-N |
| Mol Weight | 985.2 g/mol |
| Molecular Formula | C50H80N8O12 |
| Exact Mass | 984.58957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D7UroIzHh0W |
|---|---|
| Name | DOLASTATIN-11 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H80N8O12 |
| InChI | InChI=1S/C50H80N8O12/c1-17-29(7)41-46(65)52-25-38(59)56(13)36(23-27(3)4)44(63)51-26-39(60)58(15)40(28(5)6)47(66)57(14)37(24-33-19-21-34(69-16)22-20-33)45(64)53-31(9)42(61)50(11,12)49(68)54-32(10)43(62)55-35(18-2)30(8)48(67)70-41/h19-22,27-32,35-37,40-41H,17-18,23-26H2,1-16H3,(H,51,63)(H,52,65)(H,53,64)(H,54,68)(H,55,62)/t29-,30-,31-,32-,35+,36-,37-,40-,41-/m0/s1 |
| InChIKey | XOSLDLHSPLPVME-FKLVWXFWSA-N |
| Literature Reference Author | R.BAI,R.B.BATES,E.HAMEL,R.E.MOORE,P.NAKKIEW,G.R.PETTIT,B.A.S UFI |
| Literature Reference Citation | J.NAT.PROD.,65,1824(2002) |
| Literature Reference DOI | 10.1021/np020117w |
| Molecular Weight | 985.232 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI16451 |