| SpectraBase Compound ID | 9bLLiK10yXU |
|---|---|
| InChI | InChI=1S/C30H37N5O5/c1-19(2)26-29(39)33-23(17-21-12-7-4-8-13-21)30(40)35-15-9-14-24(35)28(38)31-18-25(36)32-22(27(37)34-26)16-20-10-5-3-6-11-20/h3-8,10-13,19,22-24,26H,9,14-18H2,1-2H3,(H,31,38)(H,32,36)(H,33,39)(H,34,37)/t22-,23-,24-,26+/m0/s1 |
| InChIKey | PDNKJYMGQZYDRS-JAYJDBRPSA-N |
| Mol Weight | 547.7 g/mol |
| Molecular Formula | C30H37N5O5 |
| Exact Mass | 547.279469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2GUlNoJQ5Zz |
|---|---|
| Name | DIANTHIN-F;CYCLO-(GLY-(1)-PRO-(2)-PHE-(3)-VAL-(4)-PHE-(5)) |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H37N5O5 |
| InChI | InChI=1S/C30H37N5O5/c1-19(2)26-29(39)33-23(17-21-12-7-4-8-13-21)30(40)35-15-9-14-24(35)28(38)31-18-25(36)32-22(27(37)34-26)16-20-10-5-3-6-11-20/h3-8,10-13,19,22-24,26H,9,14-18H2,1-2H3,(H,31,38)(H,32,36)(H,33,39)(H,34,37)/t22-,23-,24-,26+/m0/s1 |
| InChIKey | PDNKJYMGQZYDRS-JAYJDBRPSA-N |
| Literature Reference Author | P.W.HSIEH,F.R.CHANG,C.C.WU,K.Y.WU,C.M.LI,S.L.CHEN,Y.W.WU |
| Literature Reference Citation | J.NAT.PROD.,67,1522(2004) |
| Literature Reference DOI | 10.1021/np040036v |
| Molecular Weight | 547.654 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8087 |