| SpectraBase Compound ID | 6iQjd7y9s8l |
|---|---|
| InChI | InChI=1S/C29H32O13/c1-14(30)35-12-20-21(37-15(2)31)22(38-16(3)32)23-26(39-20)42-29(40-23)27(4)11-19(33)18-10-28(29,24(18)41-27)13-36-25(34)17-8-6-5-7-9-17/h5-9,18,20-24,26H,10-13H2,1-4H3/t18-,20-,21-,22+,23-,24-,26+,27-,28-,29+/m0/s1 |
| InChIKey | XWZQPNRXYJXQFX-BMBDVEMVSA-N |
| Mol Weight | 588.6 g/mol |
| Molecular Formula | C29H32O13 |
| Exact Mass | 588.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5d6xFvXQQrK |
|---|---|
| Name | LACTIFLORIN-TRIACETATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H32O13 |
| InChI | InChI=1S/C29H32O13/c1-14(30)35-12-20-21(37-15(2)31)22(38-16(3)32)23-26(39-20)42-29(40-23)27(4)11-19(33)18-10-28(29,24(18)41-27)13-36-25(34)17-8-6-5-7-9-17/h5-9,18,20-24,26H,10-13H2,1-4H3/t18-,20-,21-,22+,23-,24-,26+,27-,28-,29+/m0/s1 |
| InChIKey | XWZQPNRXYJXQFX-BMBDVEMVSA-N |
| Literature Reference Author | J.YU,J.A.ELIX,M.N.ISKANDER |
| Literature Reference Citation | PHYTOCHEM.,29,3859(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85347-I |
| Molecular Weight | 588.565 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU27011 |