| SpectraBase Compound ID | Hka4nkySTDh |
|---|---|
| InChI | InChI=1S/C57H96N6O13/c1-19-36(8)50-54(69)61(16)48(34(4)5)53(68)58(13)43(32-73-17)52(67)62-29-21-23-41(62)51(66)60(15)49(35(6)7)55(70)63-30-22-24-42(63)57(72)76-45(33(2)3)26-20-25-44(64)39(11)56(71)75-40(12)37(9)27-28-38(10)46(74-18)31-47(65)59(50)14/h28,31,33-37,39-45,48-50,64H,19-27,29-30,32H2,1-18H3/b38-28-,46-31+/t36-,37-,39-,40+,41+,42+,43+,44+,45+,48+,49+,50+/m1/s1 |
| InChIKey | KVKPTRMODQFMJQ-JXKLYTTCSA-N |
| Mol Weight | 1073.4 g/mol |
| Molecular Formula | C57H96N6O13 |
| Exact Mass | 1072.703537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D7hKEmy0DVY |
|---|---|
| Name | DOLASTATIN-G |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H96N6O13 |
| InChI | InChI=1S/C57H96N6O13/c1-19-36(8)50-54(69)61(16)48(34(4)5)53(68)58(13)43(32-73-17)52(67)62-29-21-23-41(62)51(66)60(15)49(35(6)7)55(70)63-30-22-24-42(63)57(72)76-45(33(2)3)26-20-25-44(64)39(11)56(71)75-40(12)37(9)27-28-38(10)46(74-18)31-47(65)59(50)14/h28,31,33-37,39-45,48-50,64H,19-27,29-30,32H2,1-18H3/b38-28-,46-31+/t36-,37-,39-,40+,41+,42+,43+,44+,45+,48+,49+,50+/m1/s1 |
| InChIKey | KVKPTRMODQFMJQ-JXKLYTTCSA-N |
| Literature Reference Author | T.MUTOU,T.KONDO,M.OJIKA,K.YAMADA |
| Literature Reference Citation | J.ORG.CHEM.,61,6340(1996) |
| Literature Reference DOI | 10.1021/jo9608228 |
| Molecular Weight | 1073.422 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWCS21692 |