SpectraBase Spectrum ID |
CAncGmVZ8A0 |
Name |
11-Methoxycurvularin diacetate (isomer 2) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
406.162767789 u |
Formula |
C21H26O8 |
InChI |
InChI=1S/C21H26O8/c1-12-6-5-7-16(26-4)10-18(24)21-15(9-20(25)27-12)8-17(28-13(2)22)11-19(21)29-14(3)23/h8,11-12,16H,5-7,9-10H2,1-4H3/t12-,16?/m0/s1 |
InChIKey |
JAXJZOVROOHTIV-HKALDPMFSA-N |
Molecular Weight |
406.431 g/mol |
SMILES |
C1=C(C=C2C(=C1OC(=O)C)C(CC(CCC[C@@](OC(C2)=O)(C)[H])OC)=O)OC(=O)C |