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LSM-12175

PropertiesImageOccurences in reactions
MNX_IDMNXM528423Image of MNXM528423
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC32H36FN3O5S
charge0
mass593.23597
referencechebi:100801
InChIKeyPCQGWFREXHAZIT-XJGOYTCSSA-N
InChIInChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m1/s1
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@H]1CN(C)S(=O)(=O)c1ccccc1F
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:100801
chebi:100801
LSM-12175