| SpectraBase Spectrum ID |
BR6x1FNQu9d |
| Name |
Margocillin methyl ether |
| Alternate Name(s) |
12-Methoxy-3.beta.-hydroxyabietaa-8,11,13-trien-7-one
(2S,4aS)-2-hydroxy-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one
(2S,4aS)-6-methoxy-1,1,4a-trimethyl-2-oxidanyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O3 |
| InChI |
InChI=1S/C21H30O3/c1-12(2)13-9-14-15(10-17(13)24-6)21(5)8-7-19(23)20(3,4)18(21)11-16(14)22/h9-10,12,18-19,23H,7-8,11H2,1-6H3/t18?,19-,21+/m0/s1 |
| InChIKey |
LHADBTRIIHOXKT-IZOREMLJSA-N |
| Molecular Weight |
330.468 g/mol |
| SMILES |
O[C@]1(CC[C@@]2(c3c(cc(c(c3)OC)C(C)C)C(CC2C1(C)C)=O)C)[H] |
| SPLASH |
splash10-0159-0039000000-dbe6e4b51669f1e5905b |
| Source of Spectrum |
X2-56-471-33 |
| Wiley ID |
1604837 |
