| SpectraBase Compound ID | KQIpr55CUST |
|---|---|
| InChI | InChI=1S/C33H46N4O9/c1-4-5-6-7-8-9-12-19(2)29-20(3)30(42)35-24(15-16-26(39)40)31(43)37-27(32(44)36-25(18-38)33(45)46-29)28(41)22-17-34-23-14-11-10-13-21(22)23/h10-11,13-14,17,19-20,24-25,27,29,34,38H,4-9,12,15-16,18H2,1-3H3,(H,35,42)(H,36,44)(H,37,43)(H,39,40)/t19-,20+,24-,25+,27+,29+/m1/s1 |
| InChIKey | VNRAPWIEXZLTKI-ZDSZPENHSA-N |
| Mol Weight | 642.8 g/mol |
| Molecular Formula | C33H46N4O9 |
| Exact Mass | 642.326479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3yn1eba6w1u |
|---|---|
| Name | 15G256-GAMMA |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46N4O9 |
| InChI | InChI=1S/C33H46N4O9/c1-4-5-6-7-8-9-12-19(2)29-20(3)30(42)35-24(15-16-26(39)40)31(43)37-27(32(44)36-25(18-38)33(45)46-29)28(41)22-17-34-23-14-11-10-13-21(22)23/h10-11,13-14,17,19-20,24-25,27,29,34,38H,4-9,12,15-16,18H2,1-3H3,(H,35,42)(H,36,44)(H,37,43)(H,39,40)/t19-,20+,24-,25+,27+,29+/m1/s1 |
| InChIKey | VNRAPWIEXZLTKI-ZDSZPENHSA-N |
| Literature Reference Author | G.SCHLINGMANN,L.MILNE,D.R.WILLIAMS,G.T.CARTER |
| Literature Reference Citation | J.ANTIBIOTICS,51,303(1998) |
| Literature Reference DOI | 10.7164/antibiotics.51.303 |
| Molecular Weight | 642.750 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP631 |