SpectraBase Compound ID | 5XKI5YAJZJD |
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InChI | InChI=1S/C27H32O11/c1-14-18(36-20(29)10-6-5-9-15-7-3-2-4-8-15)11-16-17(25(33)34)13-35-26(21(14)16)38-27-24(32)23(31)22(30)19(12-28)37-27/h2-10,13-14,16,18-19,21-24,26-28,30-32H,11-12H2,1H3,(H,33,34)/b9-5+,10-6+/t14-,16-,18+,19+,21-,22+,23-,24+,26+,27-/m1/s1 |
InChIKey | MSNDNUNQOBUSKE-WQIJAYMGSA-N |
Mol Weight | 532.5 g/mol |
Molecular Formula | C27H32O11 |
Exact Mass | 532.194462 g/mol |
SpectraBase Spectrum ID | 2Z9Bl9cS3bo |
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Name | 7-O-(5-PHENYL-2,4-PENTADIENOYL)-8-EPI-LOGANIC_ACID |
Compound Number | 174 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C27H32O11 |
InChI | InChI=1S/C27H32O11/c1-14-18(36-20(29)10-6-5-9-15-7-3-2-4-8-15)11-16-17(25(33)34)13-35-26(21(14)16)38-27-24(32)23(31)22(30)19(12-28)37-27/h2-10,13-14,16,18-19,21-24,26-28,30-32H,11-12H2,1H3,(H,33,34)/b9-5+,10-6+/t14-,16-,18+,19+,21-,22+,23-,24+,26+,27-/m1/s1 |
InChIKey | MSNDNUNQOBUSKE-WQIJAYMGSA-N |
Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
Literature Reference DOI | 10.1021/np50071a001 |
Molecular Weight | 532.544 g/mol |
Solvent | CDCl3:CD3OD |
Source File Reference | UWMZ16156 |