| SpectraBase Compound ID | JZfy68qJcRz |
|---|---|
| InChI | InChI=1S/C21H32O4/c1-13(2)21(25-5)10-7-15-14(12-21)16(22)11-17-19(15,3)8-6-9-20(17,4)18(23)24/h12-13,15,17H,6-11H2,1-5H3,(H,23,24)/t15-,17+,19+,20+,21+/m0/s1 |
| InChIKey | CDSMEVRLHTXVHK-NQMYEVRTSA-N |
| Mol Weight | 348.5 g/mol |
| Molecular Formula | C21H32O4 |
| Exact Mass | 348.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 52Gi57m8ZGw |
|---|---|
| Name | 13.beta.-Methoxy-7-oxoabiet-8(14)-en-18-oic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H32O4 |
| InChI | InChI=1S/C21H32O4/c1-13(2)21(25-5)10-7-15-14(12-21)16(22)11-17-19(15,3)8-6-9-20(17,4)18(23)24/h12-13,15,17H,6-11H2,1-5H3,(H,23,24)/t15-,17+,19+,20+,21+/m0/s1 |
| InChIKey | CDSMEVRLHTXVHK-NQMYEVRTSA-N |
| Molecular Weight | 348.483 g/mol |
| SMILES | OC([C@]1([C@@]2(CC(C=3[C@@]([C@]2(CCC1)C)(CC[C@@](C3)(C(C)C)OC)[H])=O)[H])C)=O |
| SPLASH | splash10-0a4i-1319000000-5a51932fc009db82e287 |
| Source of Spectrum | I-78-39-7 |
| Synonyms | (4beta)-13-methoxy-7-oxoabiet-8(14)-en-18-oic acid (1R,4aR,4bR,7S,10aR)-7-methoxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (1R,4aR,4bR,7S,10aR)-7-isopropyl-7-methoxy-1,4a-dimethyl-9-oxo-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (1R,4aR,4bR,7S,10aR)-7-methoxy-1,4a-dimethyl-9-oxidanylidene-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid |
| Wiley ID | 748111 |