| SpectraBase Compound ID | KVDxtwIYPZq |
|---|---|
| InChI | InChI=1S/C47H56N12O14/c1-27-38(64-21-20-63-28(2)60)43(69-29(3)61)45(70-30(4)62)47(68-27)73-44-39(65-24-31-14-8-5-9-15-31)34(53-57-49)22-35(54-58-50)40(44)72-46-37(55-59-51)42(67-26-33-18-12-7-13-19-33)41(36(71-46)23-52-56-48)66-25-32-16-10-6-11-17-32/h5-19,27,34-47H,20-26H2,1-4H3/t27-,34+,35-,36+,37+,38-,39-,40+,41+,42+,43+,44+,45-,46+,47+/m1/s1 |
| InChIKey | SJZIGGJDPYJPIH-VWWKJCHJSA-N |
| Mol Weight | 1013.0 g/mol |
| Molecular Formula | C47H56N12O14 |
| Exact Mass | 1012.403895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ko6B5kS7PO |
|---|---|
| Name | SJZIGGJDPYJPIH-VWWKJCHJSA-N |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H56N12O14 |
| InChI | InChI=1S/C47H56N12O14/c1-27-38(64-21-20-63-28(2)60)43(69-29(3)61)45(70-30(4)62)47(68-27)73-44-39(65-24-31-14-8-5-9-15-31)34(53-57-49)22-35(54-58-50)40(44)72-46-37(55-59-51)42(67-26-33-18-12-7-13-19-33)41(36(71-46)23-52-56-48)66-25-32-16-10-6-11-17-32/h5-19,27,34-47H,20-26H2,1-4H3/t27-,34+,35-,36+,37+,38-,39-,40+,41+,42+,43+,44+,45-,46+,47+/m1/s1 |
| InChIKey | SJZIGGJDPYJPIH-VWWKJCHJSA-N |
| Literature Reference Author | J.LI,J.WANG,Y.HUI,C.T.CHANG |
| Literature Reference Citation | ORG.LETTERS,5,431(2003) |
| Literature Reference DOI | 10.1021/ol027288c |
| Molecular Weight | 1013.034 g/mol |
| Sample ID | 49424 |
| Solvent | CDCl3 |