| SpectraBase Compound ID | Kfh7J1dhfrB |
|---|---|
| InChI | InChI=1S/C44H60N8O10/c1-25(2)21-30-39(57)47-32(23-29-15-9-6-10-16-29)40(58)46-31(22-28-13-7-5-8-14-28)38(56)45-24-35(55)49-36(26(3)53)43(61)52-20-12-18-34(52)42(60)50-37(27(4)54)44(62)51-19-11-17-33(51)41(59)48-30/h5-10,13-16,25-27,30-34,36-37,53-54H,11-12,17-24H2,1-4H3,(H,45,56)(H,46,58)(H,47,57)(H,48,59)(H,49,55)(H,50,60)/t26?,27?,30-,31-,32-,33-,34?,36-,37-/m0/s1 |
| InChIKey | JTXHBBPWZXMCCJ-DIKKVRSFSA-N |
| Mol Weight | 861.0 g/mol |
| Molecular Formula | C44H60N8O10 |
| Exact Mass | 860.44324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Uwpd4OTzKD |
|---|---|
| Name | PSEUDOSTELLARIN-H;CYCLO-(GLY-THR-PRO-THR-PRO-LEU-PHE-PHE) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H60N8O10 |
| InChI | InChI=1S/C44H60N8O10/c1-25(2)21-30-39(57)47-32(23-29-15-9-6-10-16-29)40(58)46-31(22-28-13-7-5-8-14-28)38(56)45-24-35(55)49-36(26(3)53)43(61)52-20-12-18-34(52)42(60)50-37(27(4)54)44(62)51-19-11-17-33(51)41(59)48-30/h5-10,13-16,25-27,30-34,36-37,53-54H,11-12,17-24H2,1-4H3,(H,45,56)(H,46,58)(H,47,57)(H,48,59)(H,49,55)(H,50,60)/t26?,27?,30-,31-,32-,33-,34?,36-,37-/m0/s1 |
| InChIKey | JTXHBBPWZXMCCJ-DIKKVRSFSA-N |
| Literature Reference Author | H.MORITA,T.KAYASHITA,K.TAKEYA,H.ITOKAWA |
| Literature Reference Citation | J.NAT.PROD.,58,943(1995) |
| Literature Reference DOI | 10.1021/np50120a021 |
| Molecular Weight | 861.008 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVP6519 |