| SpectraBase Compound ID | EDb6iKLwufH |
|---|---|
| InChI | InChI=1S/C58H104N6O26/c1-6-7-8-9-10-11-12-13-14-15-40(65)59-22-31-85-56-53(78)50(75)47(72)37(88-56)34-62(25-16-41(66)60-23-32-86-57-54(79)51(76)48(73)38(89-57)35-63(27-18-43(68)81-2)28-19-44(69)82-3)26-17-42(67)61-24-33-87-58-55(80)52(77)49(74)39(90-58)36-64(29-20-45(70)83-4)30-21-46(71)84-5/h37-39,47-58,72-80H,6-36H2,1-5H3,(H,59,65)(H,60,66)(H,61,67)/t37-,38-,39+,47-,48-,49+,50+,51+,52-,53-,54-,55+,56-,57-,58+/m1/s1 |
| InChIKey | VAXSOZCWAZISBL-JOBDWHARSA-N |
| Mol Weight | 1301.5 g/mol |
| Molecular Formula | C58H104N6O26 |
| Exact Mass | 1300.700027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2NQiozllcxJ |
|---|---|
| Name | VAXSOZCWAZISBL-JOBDWHARSA-N |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H104N6O26 |
| InChI | InChI=1S/C58H104N6O26/c1-6-7-8-9-10-11-12-13-14-15-40(65)59-22-31-85-56-53(78)50(75)47(72)37(88-56)34-62(25-16-41(66)60-23-32-86-57-54(79)51(76)48(73)38(89-57)35-63(27-18-43(68)81-2)28-19-44(69)82-3)26-17-42(67)61-24-33-87-58-55(80)52(77)49(74)39(90-58)36-64(29-20-45(70)83-4)30-21-46(71)84-5/h37-39,47-58,72-80H,6-36H2,1-5H3,(H,59,65)(H,60,66)(H,61,67)/t37-,38-,39+,47-,48-,49+,50+,51+,52-,53-,54-,55+,56-,57-,58+/m1/s1 |
| InChIKey | VAXSOZCWAZISBL-JOBDWHARSA-N |
| Literature Reference Author | M.DUBBER,A.PATEL,K.SADALAPURE,I.AUMUELLER,T.K.LINDHORST |
| Literature Reference Citation | EUR.J.ORG.CHEM.,5357(2006) |
| Molecular Weight | 1301.488 g/mol |
| Sample ID | 44688 |
| Solvent | CD3OD |