| SpectraBase Spectrum ID |
JwrfgbpWjwV |
| Name |
17-triene-4,5-dicarboxylate |
| Alternate Name(s) |
Diethyl trans,trans-(1.alpha.,2.beta.,3.alpha.,6.alpha.,7.beta.,8.alpha.,9.beta.,10.alpha.,13.alpha.,14.beta.)-19,20-bis(acetoxymethyl)-hexacyclo[6.6.2.2(3,6).2(10,13).0(2,7).0(9,14)]eicosa-11,15, |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H40O8 |
| InChI |
InChI=1S/C32H40O8/c1-5-37-31(35)29-21-11-12-22(30(29)32(36)38-6-2)28-20-10-9-19(27(21)28)25-17-7-8-18(26(20)25)24(14-40-16(4)34)23(17)13-39-15(3)33/h7-12,17-30H,5-6,13-14H2,1-4H3/t17-,18+,19-,20+,21-,22+,23?,24?,25+,26-,27+,28-,29?,30? |
| InChIKey |
MMTDSBCKWCDHLZ-QJDUHYSKSA-N |
| Molecular Weight |
552.664 g/mol |
| SMILES |
[C@@]12([C@@]([C@@]3([H])[C@]4([C@@]([C@@]2(C=C3)[H])([C@@]2(C(C(COC(=O)C)[C@@]4([H])C=C2)COC(=O)C)[H])[H])[H])([C@@]2([H])C=C[C@@]1(C(C2C(=O)OCC)C(=O)OCC)[H])[H])[H] |
| SPLASH |
splash10-0udi-2903410000-8d0e438e8fa828485618 |
| Source of Spectrum |
F-59-1498-17a,b |
| Wiley ID |
1677193 |
