| SpectraBase Compound ID | LBrab4BG5lt |
|---|---|
| InChI | InChI=1S/C27H34O13/c1-12-18-19(21(31)24(12)39-17(29)9-6-13-4-7-14(35-2)8-5-13)15(25(34)36-3)11-37-26(18)40-27-23(33)22(32)20(30)16(10-28)38-27/h4-9,11-12,16,18-24,26-28,30-33H,10H2,1-3H3/b9-6+/t12-,16-,18?,19?,20-,21+,22+,23-,24-,26+,27+/m0/s1 |
| InChIKey | PSOYNZJMRVQTDR-HFXQJXPUSA-N |
| Mol Weight | 566.6 g/mol |
| Molecular Formula | C27H34O13 |
| Exact Mass | 566.199941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOgDTaxrCwk |
|---|---|
| Name | ARBORTRISTOSIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O13 |
| InChI | InChI=1S/C27H34O13/c1-12-18-19(21(31)24(12)39-17(29)9-6-13-4-7-14(35-2)8-5-13)15(25(34)36-3)11-37-26(18)40-27-23(33)22(32)20(30)16(10-28)38-27/h4-9,11-12,16,18-24,26-28,30-33H,10H2,1-3H3/b9-6+/t12-,16-,18?,19?,20-,21+,22+,23-,24-,26+,27+/m0/s1 |
| InChIKey | PSOYNZJMRVQTDR-HFXQJXPUSA-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 | 566.559 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS92 |