| SpectraBase Compound ID | KzOZnlGGCJo |
|---|---|
| InChI | InChI=1S/C31H44N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(13-8-20-4-9-23(39)10-5-20)36-29(43)27(41)16-21-6-11-24(40)12-7-21/h4-7,9-12,19,22,25-27,38-41H,2-3,8,13-18H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19?,22-,25-,26+,27-/m1/s1 |
| InChIKey | LRHLULGPZSFCCN-BIAGWNRSSA-N |
| Mol Weight | 612.7 g/mol |
| Molecular Formula | C31H44N6O7 |
| Exact Mass | 612.327148 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6KIleI87BNx |
|---|---|
| Name | SPUMIGIN_A;HPLA-HTY-4-ME-PRO-ARGININOL;ISOMER_1 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H44N6O7 |
| InChI | InChI=1S/C31H44N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(13-8-20-4-9-23(39)10-5-20)36-29(43)27(41)16-21-6-11-24(40)12-7-21/h4-7,9-12,19,22,25-27,38-41H,2-3,8,13-18H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19?,22-,25-,26+,27-/m1/s1 |
| InChIKey | LRHLULGPZSFCCN-BIAGWNRSSA-N |
| Literature Reference Author | A.R.J.ANAS,T.KISUGI,T.UMEZAWA,F.MATSUDA,M.R.CAMPITELLI,R.J.Q UINN,T.OKINO |
| Literature Reference Citation | J.NAT.PROD.,75,1546(2012) |
| Literature Reference DOI | 10.1021/np300282a |
| Molecular Weight | 612.726 g/mol |
| Sample ID | 41409 |
| Solvent | DMSO-D6 |