| SpectraBase Compound ID | 8utQ6kZNoN4 |
|---|---|
| InChI | InChI=1S/C28H46N6O16/c1-8(36)19(41)21(14(7-35)31-10(3)37)47-28-18(34-13(6)40)16(32-11(4)38)22(24(50-28)26(45)46)48-27-17(33-12(5)39)15(30-9(2)29)20(42)23(49-27)25(43)44/h8,14-24,27-28,35-36,41-42H,7H2,1-6H3,(H2,29,30)(H,31,37)(H,32,38)(H,33,39)(H,34,40)(H,43,44)(H,45,46)/t8-,14+,15+,16+,17-,18-,19+,20-,21-,22-,23-,24-,27+,28+/m0/s1 |
| InChIKey | VFFNKDLHVDNDOB-ICPKEYSYSA-N |
| Mol Weight | 722.7 g/mol |
| Molecular Formula | C28H46N6O16 |
| Exact Mass | 722.297029 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hr4Ykl2YfUy |
|---|---|
| Name | BIOSIDE 2 (FROM PSEUDOMONAS AERUGINOSA O) |
| Comments | S |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H46N6O16 |
| InChI | InChI=1S/C28H46N6O16/c1-8(36)19(41)21(14(7-35)31-10(3)37)47-28-18(34-13(6)40)16(32-11(4)38)22(24(50-28)26(45)46)48-27-17(33-12(5)39)15(30-9(2)29)20(42)23(49-27)25(43)44/h8,14-24,27-28,35-36,41-42H,7H2,1-6H3,(H2,29,30)(H,31,37)(H,32,38)(H,33,39)(H,34,40)(H,43,44)(H,45,46)/t8-,14+,15+,16+,17-,18-,19+,20-,21-,22-,23-,24-,27+,28+/m0/s1 |
| InChIKey | VFFNKDLHVDNDOB-ICPKEYSYSA-N |
| Instrument Name | Bruker AM-300 |
| Literature Reference | YU.A.KNIREL, N.A.PARAMONOV, E.V.VINOGRADOV, A.S.SHASHKOV, B.A.DMITRIEV,N.K.KOCHETKOV, E.S.STANISLAVSKY (1986) Bioorganich.Khim.(Russ. Lang.): v.12,N12, 1649-1657. |
| NMR Standard | CH3OH |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |