| Properties | Image | Occurences in reactions |
MNX_ID | MNXM30207 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C44H36N2O9 |
charge | 0 |
mass | 736.24208 |
reference | chebi:31024 |
InChIKey | MQZDOSAHCDNWQT-LQJZCPKCSA-N |
InChI | InChI=1S/C44H36N2O9/c1-45-32(31-18-40-39(54-21-55-40)17-30(31)27-8-6-23-12-36-38(53-20-51-36)16-29(23)43(27)45)13-24(47)14-33-41-25(9-10-34(48-3)44(41)49-4)26-7-5-22-11-35-37(52-19-50-35)15-28(22)42(26)46(33)2/h5-12,15-18,32-33H,13-14,19-21H2,1-4H3/t32-,33-/m0/s1 |
SMILES | COc1ccc2c(c1OC)[C@H](CC(=O)C[C@H]1c3cc4c(cc3-c3ccc5cc6c(cc5c3N1C)OCO6)OCO4)N(C)c1c-2ccc2cc3c(cc12)OCO3 |
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