| SpectraBase Compound ID | CG7roAoogpF |
|---|---|
| InChI | InChI=1S/C25H42N4O14/c1-8(32)27-14-17(35)16(34)12(7-38-4)40-23(14)42-22-11(6-31)39-24(15(19(22)37)28-9(2)33)41-21-10(5-30)20-13(18(21)36)29-25(26-3)43-20/h10-24,30-31,34-37H,5-7H2,1-4H3,(H,26,29)(H,27,32)(H,28,33)/t10-,11-,12+,13+,14+,15-,16+,17-,18+,19+,20-,21+,22-,23-,24+/m0/s1 |
| InChIKey | MJUOPNSEEIKMFW-ASZNSDIHSA-N |
| Mol Weight | 622.6 g/mol |
| Molecular Formula | C25H42N4O14 |
| Exact Mass | 622.269752 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 54CLZtCs5CL |
|---|---|
| Name | METHYL-N-DEMETHYLALLOSAMIDIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42N4O14 |
| InChI | InChI=1S/C25H42N4O14/c1-8(32)27-14-17(35)16(34)12(7-38-4)40-23(14)42-22-11(6-31)39-24(15(19(22)37)28-9(2)33)41-21-10(5-30)20-13(18(21)36)29-25(26-3)43-20/h10-24,30-31,34-37H,5-7H2,1-4H3,(H,26,29)(H,27,32)(H,28,33)/t10-,11-,12+,13+,14+,15-,16+,17-,18+,19+,20-,21+,22-,23-,24+/m0/s1 |
| InChIKey | MJUOPNSEEIKMFW-ASZNSDIHSA-N |
| Literature Reference Author | Y.NISHIMOTO,S.SAKUDA,S.TAKAYAMA,Y.YAMADA |
| Literature Reference Citation | J.ANTIBIOTICS,44,716(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.716 |
| Molecular Weight | 622.627 g/mol |
| Sample ID | 66514 |
| Solvent | D2O:CD3CN=9:1 |