| Properties | Image | Occurences in reactions |
MNX_ID | MNXM105866 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C30H31NO9 |
charge | 0 |
mass | 549.19988 |
reference | chebi:68985 |
InChIKey | YMBCQAMVBMTDAL-BEJQPSFTSA-N |
InChI | InChI=1S/C30H31NO9/c1-4-5-8-17-30(37)40-29-16-10-13(2)11-18(32)22(16)24-25(31(17)29)28(36)23-15(27(24)35)7-6-9-20(23)39-21-12-19(33)26(34)14(3)38-21/h6-7,9-11,14,17,19,21,26,29,32-34H,4-5,8,12H2,1-3H3/t14-,17+,19+,21-,26-,29?/m0/s1 |
SMILES | CCCC[C@@H]1C(=O)OC2c3cc(C)cc(O)c3C3=C(C(=O)c4c(O[C@H]5C[C@@H](O)[C@@H](O)[C@H](C)O5)cccc4C3=O)N21 |
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