| SpectraBase Spectrum ID |
D88wvnqIivm |
| Name |
ent-11.alpha..-Hydroxy-2,3-seco-13-epi-manoyl oxide-2,3-dioic acid 2-methyl ester |
| Alternate Name(s) |
2-[(2R,4S,5R,8aS)-4-hydroxy-5-(2-methoxy-2-oxoethyl)-2,5,8a-trimethyl-2-vinyloctahydro-2H-chromen-6-yl]-2-methylpropanoic acid
ent-11.alpha..-Hydroxy-2,3-seco-13-epi-manoyl oxide-2,3-dioic acid 3-methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H34O6 |
| InChI |
InChI=1S/C21H34O6/c1-8-19(4)11-13(22)16-20(5,12-15(23)24)14(9-10-21(16,6)27-19)18(2,3)17(25)26-7/h8,13-14,16,22H,1,9-12H2,2-7H3,(H,23,24)/t13-,14?,16?,19-,20+,21-/m0/s1 |
| InChIKey |
VEKAGTMMLFMMHC-OMIVQYPGSA-N |
| Molecular Weight |
382.497 g/mol |
| SMILES |
O[C@]1(C[C@@](O[C@@]2(C1[C@](CC(=O)O)(C(CC2)C(C(=O)OC)(C)C)C)C)(C=C)C)[H] |
| SPLASH |
splash10-004i-0094000000-b23c56f68e812339713e |
| Source of Spectrum |
F-55-1792-20 |
| Wiley ID |
836684 |
