SpectraBase Spectrum ID |
9T3LOM9CqUI |
Name |
3.beta.,15.beta.,16,18-Tetaacetoxy-ent-ros-5-ene |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
506.287968304 u |
Formula |
C28H42O8 |
InChI |
InChI=1S/C28H42O8/c1-17(29)33-15-25(36-20(4)32)26(5)12-13-27(6)21(14-26)8-9-23-22(27)10-11-24(35-19(3)31)28(23,7)16-34-18(2)30/h9,21-22,24-25H,8,10-16H2,1-7H3/t21-,22-,24+,25?,26-,27-,28+/m1/s1 |
InChIKey |
JPJCGILJSBASIX-UEUWRWPCSA-N |
Molecular Weight |
506.636 g/mol |
SMILES |
C1=2[C@@]([C@@](OC(=O)C)(CC[C@]1([C@@]1(CC[C@](C[C@]1(CC2)[H])(C(OC(=O)C)COC(=O)C)C)C)[H])[H])(COC(=O)C)C |