| SpectraBase Spectrum ID |
Jq8TQhLyNJM |
| Name |
9(1H)-Phenanthrenone, 2,3,4,4a-tetrahydro-5,8,10-trihydroxy-6-methoxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (S)- |
| Alternate Name(s) |
(10alpha)-6,11,14-trihydroxy-12-methoxyabieta-5,8,11,13-tetraen-7-one
7-oxo-12-methoxy-6,11,14-trihydroxy-abieta-5,8,11,13-tetraene |
| CAS Registry Number |
124183-18-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O5 |
| InChI |
InChI=1S/C21H28O5/c1-10(2)11-14(22)12-13(16(24)18(11)26-6)21(5)9-7-8-20(3,4)19(21)17(25)15(12)23/h10,22,24-25H,7-9H2,1-6H3/t21-/m0/s1 |
| InChIKey |
QWFMIWDUMBELIV-NRFANRHFSA-N |
| Molecular Weight |
360.450 g/mol |
| SMILES |
OC1=C2C(CCC[C@]2(c2c(c(c(c(c2O)OC)C(C)C)O)C1=O)C)(C)C |
| SPLASH |
splash10-0002-0009000000-1ba22f74366e1199eaba |
| Source of Spectrum |
I-67-3-7 |
| Wiley ID |
1348463 |
