| SpectraBase Spectrum ID |
8SrphJq2TYd |
| Name |
BETA-HYDROXYISOVALERYLSHIKONIN |
| Compound Number |
1 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C21H24O7 |
| InChI |
InChI=1S/C21H24O7/c1-11(2)5-8-16(28-17(25)10-21(3,4)27)12-9-15(24)18-13(22)6-7-14(23)19(18)20(12)26/h5-7,9,16,22-23,27H,8,10H2,1-4H3/t16-/m1/s1 |
| InChIKey |
MXANJRGHSFELEJ-MRXNPFEDSA-N |
| Literature Reference Author |
N.KRETSCHMER,B.RINNER,A.J.A.DEUTSCH,B.LOHBERGER,H.KNAUSZ,O.K
UNERT,M.BLUNDER,H.BO |
| Literature Reference Citation |
J.NAT.PROD.,75,865(2012) |
| Literature Reference DOI |
10.1021/np2006499 |
| Molecular Weight |
388.417 g/mol |
| Sample ID |
40385 |
| Solvent |
CDCl3 |
