| SpectraBase Spectrum ID |
1hKGSWVopiT |
| Name |
D-3-hydroxy-9(11)-secoestra-1,3,5(10),16-tetraen-11,17-dioic acid dimethyl ester |
| Alternate Name(s) |
Methyl (5S)-4-(6-hydroxy-1,2,3,4-tetrahydro-2-naphthalenyl)-5-(2-methoxy-2-oxoethyl)-5-methyl-1-cyclopentene-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O5 |
| InChI |
InChI=1S/C21H26O5/c1-21(12-19(23)25-2)17(8-9-18(21)20(24)26-3)15-5-4-14-11-16(22)7-6-13(14)10-15/h6-7,9,11,15,17,22H,4-5,8,10,12H2,1-3H3/t15?,17?,21-/m0/s1 |
| InChIKey |
KIMWLCJKOVQDOC-GRXDXKALSA-N |
| Molecular Weight |
358.434 g/mol |
| SMILES |
Oc1cc2CCC(C3[C@@](C(=CC3)C(=O)OC)(CC(=O)OC)C)Cc2cc1 |
| SPLASH |
splash10-000t-0966000000-9d201235d36aaebeef6a |
| Source of Spectrum |
F-32-83-1 |
| Wiley ID |
1347157 |
