| Properties | Image | Occurences in reactions |
MNX_ID | MNXM148075 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 3 |
in models (compartimentalized) |
0 |
|
formula | C25H30O5 |
charge | 0 |
mass | 410.20932 |
reference | metacycM:CPD-17336 |
InChIKey | PIZDGYFPLPPVBP-NPEZIVKXSA-N |
InChI | InChI=1S/C25H30O5/c1-20(2)13-6-9-24-11-22(4)17(27)16-18(28)30-12-25(16,24)23(5,19(22)29)10-14(24)21(13,3)8-7-15(20)26/h7-8,13-14,16H,6,9-12H2,1-5H3/t13-,14-,16+,21-,22-,23-,24-,25+/m0/s1 |
SMILES | CC1(C)C(=O)C=C[C@]2(C)[C@@H]3C[C@@]4(C)C(=O)[C@@]5(C)C[C@]3(CC[C@@H]12)[C@@]41COC(=O)[C@H]1C5=O |
|