| SpectraBase Compound ID | I6GjMz4M4mQ |
|---|---|
| InChI | InChI=1S/C94H130N6O10/c1-85(2,3)69-41-57-35-61-45-71(87(7,8)9)49-65(81(61)107-53-75(101)97-91(19,20)21)39-67-51-73(89(13,14)15)47-63(83(67)109-55-77(103)99-93(25,26)27)37-59-43-70(86(4,5)6)44-60(80(59)106-34-32-96)38-64-48-74(90(16,17)18)52-68(84(64)110-56-78(104)100-94(28,29)30)40-66-50-72(88(10,11)12)46-62(36-58(42-69)79(57)105-33-31-95)82(66)108-54-76(102)98-92(22,23)24/h41-52H,33-40,53-56H2,1-30H3,(H,97,101)(H,98,102)(H,99,103)(H,100,104) |
| InChIKey | QCFVVDLTJCWUBT-UHFFFAOYSA-N |
| Mol Weight | 1504.1 g/mol |
| Molecular Formula | C94H130N6O10 |
| Exact Mass | 1502.984844 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KgSWuoNXJla |
|---|---|
| Name | QCFVVDLTJCWUBT-UHFFFAOYSA-N |
| Compound Number | 9B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C94H130N6O10 |
| InChI | InChI=1S/C94H130N6O10/c1-85(2,3)69-41-57-35-61-45-71(87(7,8)9)49-65(81(61)107-53-75(101)97-91(19,20)21)39-67-51-73(89(13,14)15)47-63(83(67)109-55-77(103)99-93(25,26)27)37-59-43-70(86(4,5)6)44-60(80(59)106-34-32-96)38-64-48-74(90(16,17)18)52-68(84(64)110-56-78(104)100-94(28,29)30)40-66-50-72(88(10,11)12)46-62(36-58(42-69)79(57)105-33-31-95)82(66)108-54-76(102)98-92(22,23)24/h41-52H,33-40,53-56H2,1-30H3,(H,97,101)(H,98,102)(H,99,103)(H,100,104) |
| InChIKey | QCFVVDLTJCWUBT-UHFFFAOYSA-N |
| Literature Reference Author | I.M.VATSOURO,E.A.SHOKOVA,A.K.SHESTAKOVA,V.A.CHERTKOV,V.V.KOV ALEV |
| Literature Reference Citation | EUR.J.ORG.CHEM.,522(2006) |
| Molecular Weight | 1504.100 g/mol |
| Sample ID | 43614 |
| Solvent | CDCl3:CD3OH=5:1 |