| SpectraBase Compound ID | H5VCiLisdQg |
|---|---|
| InChI | InChI=1S/C41H63N13O21S/c42-18(6-1-3-12-47-33(63)17-9-10-23(76(73,74)75)30(60)29(17)59)22(55)15-25(57)50-21(14-24(43)56)36(66)54-28(32(62)40(71)72)38(68)52-19-7-2-4-11-46-26(58)16-49-37(67)27(31(61)39(69)70)53-35(65)20(51-34(19)64)8-5-13-48-41(44)45/h9-10,18-22,27-28,31-32,55,59-62H,1-8,11-16,42H2,(H2,43,56)(H,46,58)(H,47,63)(H,49,67)(H,50,57)(H,51,64)(H,52,68)(H,53,65)(H,54,66)(H,69,70)(H,71,72)(H4,44,45,48)(H,73,74,75) |
| InChIKey | FMENUGFMERBZKJ-UHFFFAOYSA-N |
| Mol Weight | 1106.1 g/mol |
| Molecular Formula | C41H63N13O21S |
| Exact Mass | 1105.398217 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LYe2cyKSZdd |
|---|---|
| Name | PSEUDOALTEROBACTIN-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H63N13O21S |
| InChI | InChI=1S/C41H63N13O21S/c42-18(6-1-3-12-47-33(63)17-9-10-23(76(73,74)75)30(60)29(17)59)22(55)15-25(57)50-21(14-24(43)56)36(66)54-28(32(62)40(71)72)38(68)52-19-7-2-4-11-46-26(58)16-49-37(67)27(31(61)39(69)70)53-35(65)20(51-34(19)64)8-5-13-48-41(44)45/h9-10,18-22,27-28,31-32,55,59-62H,1-8,11-16,42H2,(H2,43,56)(H,46,58)(H,47,63)(H,49,67)(H,50,57)(H,51,64)(H,52,68)(H,53,65)(H,54,66)(H,69,70)(H,71,72)(H4,44,45,48)(H,73,74,75) |
| InChIKey | FMENUGFMERBZKJ-UHFFFAOYSA-N |
| Literature Reference Author | K.KANOH,K.KAMINO,G.LELEO,K.ADACHI,Y.SHIZURI |
| Literature Reference Citation | J.ANTIBIOTICS,56,871(2003) |
| Literature Reference DOI | 10.7164/antibiotics.56.871 |
| Molecular Weight | 1106.086 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP3060 |