| SpectraBase Spectrum ID |
25907hOQQvs |
| Name |
Nonanoic acid, 9-[[3-methyl-1-oxo-4-[tetrahydro-3,4-dihydroxy-5-(4-methyl-2-hexenyl)-2H-pyran-2-yl]-2-butenyl]oxy]-, methyl ester, [2S-[2.alpha.(E),3.beta.,5.alpha.(2E,4R*)]]- |
| Alternate Name(s) |
9-Methoxy-9-oxononyl (2E)-5,9-anhydro-2,3,4,8-tetradeoxy-3-methyl-8-[(2E)-4-methyl-2-hexenyl]-D-galacto-non-2-enonate
Methyl 13-deoxypseudomonate
Methyl 13-deoxypseudomonate C |
| CAS Registry Number |
112615-50-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O7 |
| InChI |
InChI=1S/C27H46O7/c1-5-20(2)13-12-14-22-19-34-23(27(31)26(22)30)17-21(3)18-25(29)33-16-11-9-7-6-8-10-15-24(28)32-4/h12-13,18,20,22-23,26-27,30-31H,5-11,14-17,19H2,1-4H3/b13-12+,21-18+/t20?,22-,23+,26+,27-/m1/s1 |
| InChIKey |
QWWFOPXGBLSJRV-MEEHOTIWSA-N |
| Molecular Weight |
482.658 g/mol |
| SMILES |
O[C@]1([C@@](CO[C@]([C@]1(O)[H])(C\C(=C\C(=O)OCCCCCCCCC(=O)OC)C)[H])(C\C=C\C(CC)C)[H])[H] |
| SPLASH |
splash10-03ka-9270200000-d6d5f3442b640563eebe |
| Source of Spectrum |
F-43-2170-2 |
| Wiley ID |
1395647 |
![Nonanoic acid, 9-[[3-methyl-1-oxo-4-[tetrahydro-3,4-dihydroxy-5-(4-methyl-2-hexenyl)-2H-pyran-2-yl]-2-butenyl]oxy]-, methyl ester, [2S-[2.alpha.(E),3.beta.,5.alpha.(2E,4R*)]]-](/api/spectrum/25907hOQQvs/structure.png?h=300&w=458 "Nonanoic acid, 9-[[3-methyl-1-oxo-4-[tetrahydro-3,4-dihydroxy-5-(4-methyl-2-hexenyl)-2H-pyran-2-yl]-2-butenyl]oxy]-, methyl ester, [2S-[2.alpha.(E),3.beta.,5.alpha.(2E,4R*)]]-")
