CLL1_006229
Molecular Formula:
C53H80N2O9S
InChI: InChI=1/C53H80N2O9S/c1-4-7-8-9-10-11-12-13-17-26-50(59)55(29-34-60-35-32-58)49-40-47(54-63-6-3)45-38-41(22-18-20-30-56)44(25-19-21-31-57)51-46-39-42(61-36-37-65-43-23-15-14-16-24-43)27-28-48(46)64-53(49,52(45)51)62-33-5-2/h5,14-16,23-24,27-28,38-39,41,44,49,51-52,56-58H,2,4,6-13,17-22,25-26,29-37,40H2,1,3H3/t41-,44+,49-,51+,52+,53+/m0/s1
InChIKey: InChIKey=QAFZTKBEFTUCNO-RJGWQFMBBP
SMILES: CCCCCCCCCCCC(=O)N(CCOCCO)C1CC(=NOCC)C2=CC(C(C3C2C1(OC4=C3C=C(C=C4)OCCSC5=CC=CC=C5)OCC=C)CCCCO)CCCCO
Names:
CLL1_006229
Registries:
PubChem CID 6632477
PubChem ID 11249944
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