PubChem4835497

Molecular Formula: C₅₇H₇₈N₂O₉S

InChI: InChI=1/C57H78N2O9S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-36-69-54-40-52(58-66-42-43-27-29-46(30-28-43)59(63)64)50-38-45(24-17-19-33-60)49(26-18-20-34-61)55-51-39-48(67-47-25-22-23-44(37-47)41-62)31-32-53(51)68-57(54,56(50)55)65-35-4-2/h4,22-23,25,27-32,37-39,41,45,49,54-56,60-61H,2-3,5-21,24,26,33-36,40,42H2,1H3

InChIKey: InChIKey=ZJXFALVGHIHIHQ-UHFFFAOYAQ
SMILES: CCCCCCCCCCCCCCCCSC1CC(=NOCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC(C(C4C3C1(OC5=C4C=C(C=C5)OC6=CC=CC(=C6)C=O)OCC=C)CCCCO)CCCCO

Names:
    PubChem4835497

Registries:
    PubChem CID 3569824
    PubChem ID 4835497