| SpectraBase Compound ID | BPD4DdYUcIq |
|---|---|
| InChI | InChI=1S/C66H69N5O19/c1-76-61-64(52(79-34-40-22-10-4-11-23-40)49-46(85-61)37-82-55(88-49)43-28-16-7-17-29-43,58(72)69-66(60(74)75)54(81-36-42-26-14-6-15-27-42)51-48(87-63(66)78-3)39-84-57(90-51)45-32-20-9-21-33-45)68-59(73)65(70-71-67)53(80-35-41-24-12-5-13-25-41)50-47(86-62(65)77-2)38-83-56(89-50)44-30-18-8-19-31-44/h4-33,46-57,61-63H,34-39H2,1-3H3,(H,68,73)(H,69,72)(H,74,75)/t46-,47+,48-,49-,50+,51-,52+,53-,54+,55-,56+,57-,61+,62-,63+,64-,65+,66-/m0/s1 |
| InChIKey | ZYOMUIBTGUJLFT-PKCPIZFCSA-N |
| Mol Weight | 1236.3 g/mol |
| Molecular Formula | C66H69N5O19 |
| Exact Mass | 1235.458675 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L98M3v74a1b |
|---|---|
| Name | ZYOMUIBTGUJLFT-PKCPIZFCSA-N |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H69N5O19 |
| InChI | InChI=1S/C66H69N5O19/c1-76-61-64(52(79-34-40-22-10-4-11-23-40)49-46(85-61)37-82-55(88-49)43-28-16-7-17-29-43,58(72)69-66(60(74)75)54(81-36-42-26-14-6-15-27-42)51-48(87-63(66)78-3)39-84-57(90-51)45-32-20-9-21-33-45)68-59(73)65(70-71-67)53(80-35-41-24-12-5-13-25-41)50-47(86-62(65)77-2)38-83-56(89-50)44-30-18-8-19-31-44/h4-33,46-57,61-63H,34-39H2,1-3H3,(H,68,73)(H,69,72)(H,74,75)/t46-,47+,48-,49-,50+,51-,52+,53-,54+,55-,56+,57-,61+,62-,63+,64-,65+,66-/m0/s1 |
| InChIKey | ZYOMUIBTGUJLFT-PKCPIZFCSA-N |
| Literature Reference Author | A.SCAFFIDI,B.W.SKELTON,R.V.STICK,A.H.WHITE |
| Literature Reference Citation | AUSTR.J.CHEM.,57,733(2004) |
| Literature Reference DOI | 10.1071/CH04014 |
| Molecular Weight | 1236.296 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN20008 |