| SpectraBase Spectrum ID |
CEsCBqcy2aa |
| Name |
(2.beta., 5.xi., 9.xi.)-Kaur-16-ene-2,18,19-triol, 3ac derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.266838938 u |
| Formula |
C26H38O6 |
| InChI |
InChI=1S/C26H38O6/c1-16-10-25-9-8-23-24(5,22(25)7-6-20(16)11-25)12-21(32-19(4)29)13-26(23,14-30-17(2)27)15-31-18(3)28/h20-23H,1,6-15H2,2-5H3/t20-,21+,22?,23?,24+,25-/m1/s1 |
| InChIKey |
HKWCQODBVLALEV-JUTONGAOSA-N |
| Molecular Weight |
446.584 g/mol |
| SMILES |
C=C1[C@]2(C[C@@]3(CCC4C(C[C@](C[C@@]4(C)C3CC2)(OC(=O)C)[H])(COC(=O)C)COC(=O)C)C1)[H] |
