![3-[O-(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(TRI-O-ACETYL-BETA-D-GLUCOSYL)-(1->4)-TRI-O-ACETYL-BETA-D-GLUCOSYL]-PROP-1-ENE](/api/spectrum/7ijUuWj8csH/structure.png?h=300&w=458 "3-[O-(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(TRI-O-ACETYL-BETA-D-GLUCOSYL)-(1->4)-TRI-O-ACETYL-BETA-D-GLUCOSYL]-PROP-1-ENE")
| SpectraBase Compound ID | 74waQ4wjHAm |
|---|---|
| InChI | InChI=1S/C41H56O25/c1-12-13-27-31(55-20(5)45)35(57-22(7)47)33(28(62-27)14-52-17(2)42)65-41-39(61-26(11)51)37(59-24(9)49)34(30(64-41)16-54-19(4)44)66-40-38(60-25(10)50)36(58-23(8)48)32(56-21(6)46)29(63-40)15-53-18(3)43/h12,27-41H,1,13-16H2,2-11H3/t27-,28+,29-,30-,31-,32-,33+,34-,35+,36+,37+,38-,39-,40+,41+/m0/s1 |
| InChIKey | QDNRTPTWSKXWMD-AXKXRXETSA-N |
| Mol Weight | 948.9 g/mol |
| Molecular Formula | C41H56O25 |
| Exact Mass | 948.311067 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7ijUuWj8csH |
|---|---|
| Name | 3-[O-(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(TRI-O-ACETYL-BETA-D-GLUCOSYL)-(1->4)-TRI-O-ACETYL-BETA-D-GLUCOSYL]-PROP-1-ENE |
| Compound Number | 9(N=1) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H56O25 |
| InChI | InChI=1S/C41H56O25/c1-12-13-27-31(55-20(5)45)35(57-22(7)47)33(28(62-27)14-52-17(2)42)65-41-39(61-26(11)51)37(59-24(9)49)34(30(64-41)16-54-19(4)44)66-40-38(60-25(10)50)36(58-23(8)48)32(56-21(6)46)29(63-40)15-53-18(3)43/h12,27-41H,1,13-16H2,2-11H3/t27-,28+,29-,30-,31-,32-,33+,34-,35+,36+,37+,38-,39-,40+,41+/m0/s1 |
| InChIKey | QDNRTPTWSKXWMD-AXKXRXETSA-N |
| Literature Reference Author | J.K.FAIRWEATHER,R.V.STICK,S.G.WITHERS |
| Literature Reference Citation | AUSTR.J.CHEM.,53,913(2000) |
| Literature Reference DOI | 10.1071/CH00125 |
| Molecular Weight | 948.881 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI3126 |