AIDS-130620

Molecular Formula: C₄₄H₅₀N₄O₁₂

InChI: InChI=1/C44H50N4O12/c1-43(2,3)59-41(55)45-27(19-23-13-9-7-10-14-23)39(53)57-21-47-35(49)31-25-17-18-26(32(31)36(47)50)30-29(25)33-34(30)38(52)48(37(33)51)22-58-40(54)28(20-24-15-11-8-12-16-24)46-42(56)60-44(4,5)6/h7-18,25-34H,19-22H2,1-6H3,(H,45,55)(H,46,56)/t25-,26+,27-,28-,29u,30?,31u,32u,33u,34u/m0/s1/f/h45-46H

InChIKey: InChIKey=NHRGBYUCNXYHPJ-IUDLUXMCDY
SMILES: CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OCN2C(=O)C3C4C=CC(C3C2=O)C5C4C6C5C(=O)N(C6=O)COC(=O)C(CC7=CC=CC=C7)NC(=O)OC(C)(C)C

Names:
    AIDS-130620
    AIDS130620
    NSC607316
    N-(tert-Butoxycarbonyl)phenylalanine - octahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7-tetrone (2:1)

Registries:
    PubChem CID 6477021
    PubChem ID 226569