| SpectraBase Compound ID | HxTzqDn7tZR |
|---|---|
| InChI | InChI=1S/C42H48O23/c1-18(43)54-15-27-34-33(37(60-23(6)48)35(27)64-32(51)13-11-26-10-12-29(57-20(3)45)30(14-26)58-21(4)46)28(40(52)53-9)16-56-41(34)65-42-39(62-25(8)50)38(61-24(7)49)36(59-22(5)47)31(63-42)17-55-19(2)44/h10-14,16,27,31,33-39,41-42H,15,17H2,1-9H3/b13-11+/t27-,31-,33?,34?,35-,36-,37+,38+,39-,41+,42+/m0/s1 |
| InChIKey | SIEVOVLHQGRZTA-AEROMOIOSA-N |
| Mol Weight | 920.8 g/mol |
| Molecular Formula | C42H48O23 |
| Exact Mass | 920.258638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6DImkOdsC31 |
|---|---|
| Name | ARBORTRISTOSIDE-B-OCTAACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H48O23 |
| InChI | InChI=1S/C42H48O23/c1-18(43)54-15-27-34-33(37(60-23(6)48)35(27)64-32(51)13-11-26-10-12-29(57-20(3)45)30(14-26)58-21(4)46)28(40(52)53-9)16-56-41(34)65-42-39(62-25(8)50)38(61-24(7)49)36(59-22(5)47)31(63-42)17-55-19(2)44/h10-14,16,27,31,33-39,41-42H,15,17H2,1-9H3/b13-11+/t27-,31-,33?,34?,35-,36-,37+,38+,39-,41+,42+/m0/s1 |
| InChIKey | SIEVOVLHQGRZTA-AEROMOIOSA-N |
| Literature Reference Author | V.MATHURAM,A.B.KUNDU,D.N.MONDAL,S.BANERJEE,A.PATRA |
| Literature Reference Citation | J.NAT.PROD.,54,257(1991) |
| Literature Reference DOI | 10.1021/np50073a028 |
| Molecular Weight | 920.829 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS95 |