| SpectraBase Compound ID | AkQhsq4OV1A |
|---|---|
| InChI | InChI=1S/C53H76N2O29/c1-21-41(73-25(5)56)49(81-33(13)64)45(77-29(9)60)37(69-21)17-54(18-38-46(78-30(10)61)50(82-34(14)65)42(22(2)70-38)74-26(6)57)53(68)55(19-39-47(79-31(11)62)51(83-35(15)66)43(23(3)71-39)75-27(7)58)20-40-48(80-32(12)63)52(84-36(16)67)44(24(4)72-40)76-28(8)59/h21-24,37-52H,17-20H2,1-16H3/t21-,22-,23-,24+,37-,38-,39-,40+,41+,42+,43+,44-,45+,46+,47+,48-,49+,50+,51+,52-/m0/s1 |
| InChIKey | TWMJPZTYTWMFNN-DERINWJBSA-N |
| Mol Weight | 1205.2 g/mol |
| Molecular Formula | C53H76N2O29 |
| Exact Mass | 1204.453374 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9IZlhBt1qsY |
|---|---|
| Name | 1,1,3,3-TETRA-N-(2,3,4-TRI-O-ACETYL-BETA-L-FUCOPYRANOSYLMETHYL)-UREA |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H76N2O29 |
| InChI | InChI=1S/C53H76N2O29/c1-21-41(73-25(5)56)49(81-33(13)64)45(77-29(9)60)37(69-21)17-54(18-38-46(78-30(10)61)50(82-34(14)65)42(22(2)70-38)74-26(6)57)53(68)55(19-39-47(79-31(11)62)51(83-35(15)66)43(23(3)71-39)75-27(7)58)20-40-48(80-32(12)63)52(84-36(16)67)44(24(4)72-40)76-28(8)59/h21-24,37-52H,17-20H2,1-16H3/t21-,22-,23-,24+,37-,38-,39-,40+,41+,42+,43+,44-,45+,46+,47+,48-,49+,50+,51+,52-/m0/s1 |
| InChIKey | TWMJPZTYTWMFNN-DERINWJBSA-N |
| Literature Reference Author | P.PHIASIVONGSA,J.GALLAGHER,C.N.CHEN,P.R.JONES.V.V.SAMOSHIN,P .H.GROSS |
| Literature Reference Citation | ORG.LETTERS,4,4587(2002) |
| Literature Reference DOI | 10.1021/ol020123j |
| Molecular Weight | 1205.182 g/mol |
| Sample ID | 37940 |
| Solvent | CDCl3 |