| SpectraBase Compound ID | Jko5zFNvErX |
|---|---|
| InChI | InChI=1S/C44H70N8O11S/c1-12-25(2)34(40(59)52-21-16-19-32(52)41(60)62-43(5,6)7)51-36(55)27(4)46-37(56)29(20-22-64-11)48-35(54)26(3)47-38(57)31(24-33(45)53)49-39(58)30(23-28-17-14-13-15-18-28)50-42(61)63-44(8,9)10/h13-15,17-18,25-27,29-32,34H,12,16,19-24H2,1-11H3,(H2,45,53)(H,46,56)(H,47,57)(H,48,54)(H,49,58)(H,50,61)(H,51,55) |
| InChIKey | HPGUYKQLBGTMIX-UHFFFAOYSA-N |
| Mol Weight | 919.1 g/mol |
| Molecular Formula | C44H70N8O11S |
| Exact Mass | 918.488476 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9NecBzm5IOR |
|---|---|
| Name | N-BOC-PHE-ASN-ALA-MET-ALA-ILE-PRO-O-TBU |
| Compound Number | 9A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H70N8O11S |
| InChI | InChI=1S/C44H70N8O11S/c1-12-25(2)34(40(59)52-21-16-19-32(52)41(60)62-43(5,6)7)51-36(55)27(4)46-37(56)29(20-22-64-11)48-35(54)26(3)47-38(57)31(24-33(45)53)49-39(58)30(23-28-17-14-13-15-18-28)50-42(61)63-44(8,9)10/h13-15,17-18,25-27,29-32,34H,12,16,19-24H2,1-11H3,(H2,45,53)(H,46,56)(H,47,57)(H,48,54)(H,49,58)(H,50,61)(H,51,55) |
| InChIKey | HPGUYKQLBGTMIX-UHFFFAOYSA-N |
| Literature Reference Author | G.R.PETTIT,B.E.TOKI,J.P.XU,D.C.BRUNE |
| Literature Reference Citation | J.NAT.PROD.,63,22(2000) |
| Literature Reference DOI | 10.1021/np990253+ |
| Molecular Weight | 919.147 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU1644 |