| SpectraBase Compound ID | FvvQDxupHM0 |
|---|---|
| InChI | InChI=1S/2C46H58N8O9/c2*1-27(2)39-43(59)49-36(22-19-29-17-20-32(55)21-18-29)44(60)54(4)28(3)40(56)50-37(24-30-12-6-5-7-13-30)41(57)47-23-11-10-16-35(42(58)53-39)51-46(63)52-38(45(61)62)25-31-26-48-34-15-9-8-14-33(31)34/h2*5-9,12-15,17-18,20-21,26-28,35-39,48,55H,10-11,16,19,22-25H2,1-4H3,(H,47,57)(H,49,59)(H,50,56)(H,53,58)(H,61,62)(H2,51,52,63)/t2*28-,35+,36-,37-,38?,39-/m00/s1 |
| InChIKey | PZELPLXTFUZBQY-PIZUHOENSA-N |
| Mol Weight | 1734.0 g/mol |
| Molecular Formula | C92H116N16O18 |
| Exact Mass | 1732.865351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ENngvP1ybz8 |
|---|---|
| Name | FERINTOIC-ACID-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C92H116N16O18 |
| InChI | InChI=1S/2C46H58N8O9/c2*1-27(2)39-43(59)49-36(22-19-29-17-20-32(55)21-18-29)44(60)54(4)28(3)40(56)50-37(24-30-12-6-5-7-13-30)41(57)47-23-11-10-16-35(42(58)53-39)51-46(63)52-38(45(61)62)25-31-26-48-34-15-9-8-14-33(31)34/h2*5-9,12-15,17-18,20-21,26-28,35-39,48,55H,10-11,16,19,22-25H2,1-4H3,(H,47,57)(H,49,59)(H,50,56)(H,53,58)(H,61,62)(H2,51,52,63)/t2*28-,35+,36-,37-,38?,39-/m00/s1 |
| InChIKey | PZELPLXTFUZBQY-PIZUHOENSA-N |
| Literature Reference Author | D.E.WILLIAMS,M.CRAIG,C.F.B.HOLMES,R.J.ANDERSEN |
| Literature Reference Citation | J.NAT.PROD.,59,570(1996) |
| Literature Reference DOI | 10.1021/np960108l |
| Molecular Weight | 1734.029 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRK854 |