| SpectraBase Compound ID | Aw3F9SoJtyM |
|---|---|
| InChI | InChI=1S/C37H56N8O7/c1-19(2)16-27-35(50)45-30(20(3)4)36(51)41-23(8)32(47)42-28(17-24-18-39-26-13-10-9-12-25(24)26)34(49)38-15-11-14-29(46)40-22(7)33(48)44-31(21(5)6)37(52)43-27/h9-10,12-13,18-23,27-28,30-31,39H,11,14-17H2,1-8H3,(H,38,49)(H,40,46)(H,41,51)(H,42,47)(H,43,52)(H,44,48)(H,45,50) |
| InChIKey | STCFDPSTGTYYBQ-UHFFFAOYSA-N |
| Mol Weight | 724.9 g/mol |
| Molecular Formula | C37H56N8O7 |
| Exact Mass | 724.427196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IUOjcsVp8xf |
|---|---|
| Name | UNGUISIN-B;CYClO-(D-VALYL-D-ALANYL-D-TRYPTOPHYL-GABA-D-ALANYL-D-VALYL-L-LEUCYL) |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H56N8O7 |
| InChI | InChI=1S/C37H56N8O7/c1-19(2)16-27-35(50)45-30(20(3)4)36(51)41-23(8)32(47)42-28(17-24-18-39-26-13-10-9-12-25(24)26)34(49)38-15-11-14-29(46)40-22(7)33(48)44-31(21(5)6)37(52)43-27/h9-10,12-13,18-23,27-28,30-31,39H,11,14-17H2,1-8H3,(H,38,49)(H,40,46)(H,41,51)(H,42,47)(H,43,52)(H,44,48)(H,45,50) |
| InChIKey | STCFDPSTGTYYBQ-UHFFFAOYSA-N |
| Literature Reference Author | J.MALMSTROM |
| Literature Reference Citation | J.NAT.PROD.,62,787(1999) |
| Literature Reference DOI | 10.1021/np980539z |
| Molecular Weight | 724.901 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCP7611 |