| Properties | Image | Occurences in reactions |
MNX_ID | MNXM51732 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C30H19NO9 |
charge | 0 |
mass | 537.10598 |
reference | chebi:4726 |
InChIKey | AFMYMMXSQGUCBK-CWSCUYGGSA-N |
InChI | InChI=1S/C30H19NO9/c1-12-19(28(37)38)27(39-2)13-7-5-3-4-6-8-18-29(12)30(13,40-29)14-11-17(34)22-23(24(14)31-18)26(36)21-16(33)10-9-15(32)20(21)25(22)35/h3-4,9-13,18,31-34H,1-2H3,(H,37,38)/b4-3-/t12-,13-,18?,29-,30+/m0/s1 |
SMILES | COC1=C(C(=O)O)[C@H](C)[C@@]23O[C@]24c2cc(O)c5c(c2NC3C#C/C=C\C#C[C@@H]14)C(=O)c1c(O)ccc(O)c1C5=O |
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