| Properties | Image | Occurences in reactions |
MNX_ID | MNXM101463 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C30H46O6 |
charge | 0 |
mass | 502.32944 |
reference | chebi:69363 |
InChIKey | XRUBFYYNZLBFBN-JYGFFPNFSA-N |
InChI | InChI=1S/C30H46O6/c1-25(16-31)12-13-30(24(35)36)19(14-25)18-6-7-21-26(2)10-9-22(33)27(3,17-32)20(26)8-11-28(21,4)29(18,5)15-23(30)34/h6,19-21,23,31-32,34H,7-17H2,1-5H3,(H,35,36)/t19-,20+,21+,23+,25+,26-,27-,28+,29+,30+/m0/s1 |
SMILES | C[C@@]12C[C@@H](O)[C@@]3(C(=O)O)CC[C@@](C)(CO)C[C@H]3C1=CC[C@@H]1[C@@]3(C)CCC(=O)[C@@](C)(CO)[C@@H]3CC[C@]12C |
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