| Properties | Image | Occurences in reactions |
MNX_ID | MNXM97388 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 4 |
in models (compartimentalized) |
0 |
|
formula | C28H40O9 |
charge | 0 |
mass | 520.26723 |
reference | metacycM:CPD-14478 |
InChIKey | SCJZVZRWMAAWIK-BIQSHTGTSA-N |
InChI | InChI=1S/C28H40O9/c1-13-20(34-15(3)29)10-11-28(9)22(13)24(33)19-12-21(35-16(4)30)14(2)23(27(19,7)8)25(36-17(5)31)26(28)37-18(6)32/h19-22,24-26,33H,1,10-12H2,2-9H3/t19?,20-,21-,22?,24+,25+,26-,28+/m0/s1 |
SMILES | C=C1C2[C@H](O)C3C[C@H](OC(C)=O)C(C)=C([C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]2(C)CC[C@@H]1OC(C)=O)C3(C)C |
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