| SpectraBase Compound ID | 2GoDQ6rQu6T |
|---|---|
| InChI | InChI=1S/C37H44O18/c1-17-28-29(32(50-20(4)40)30(17)54-27(43)14-11-23-9-12-24(45-7)13-10-23)25(35(44)46-8)15-48-36(28)55-37-34(52-22(6)42)33(51-21(5)41)31(49-19(3)39)26(53-37)16-47-18(2)38/h9-15,17,26,28-34,36-37H,16H2,1-8H3/b14-11+/t17-,26-,28?,29?,30-,31-,32+,33+,34-,36+,37+/m0/s1 |
| InChIKey | WGURDJPOQJMALP-JNNAVLGCSA-N |
| Mol Weight | 776.7 g/mol |
| Molecular Formula | C37H44O18 |
| Exact Mass | 776.252765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3V0ST84CpxN |
|---|---|
| Name | ARBORTRISTOSIDE-A-PENTAACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H44O18 |
| InChI | InChI=1S/C37H44O18/c1-17-28-29(32(50-20(4)40)30(17)54-27(43)14-11-23-9-12-24(45-7)13-10-23)25(35(44)46-8)15-48-36(28)55-37-34(52-22(6)42)33(51-21(5)41)31(49-19(3)39)26(53-37)16-47-18(2)38/h9-15,17,26,28-34,36-37H,16H2,1-8H3/b14-11+/t17-,26-,28?,29?,30-,31-,32+,33+,34-,36+,37+/m0/s1 |
| InChIKey | WGURDJPOQJMALP-JNNAVLGCSA-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 | 776.746 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS93 |