CAS-1397-94-0

Molecular Formula: C₂₈H₄₀N₂O₉

InChI: InChI=1/C28H40N2O9/c1-6-7-8-9-11-20-25(39-22(32)14-16(2)3)18(5)38-28(36)23(17(4)37-27(20)35)30-26(34)19-12-10-13-21(24(19)33)29-15-31/h10,12-13,15-18,20,23,25,33H,6-9,11,14H2,1-5H3,(H,29,31)(H,30,34)/t17-,18+,20-,23+,25-/m1/s1/f/h29-30H

InChIKey: InChIKey=UIFFUZWRFRDZJC-ZLLIGASJDZ
SMILES: CCCCCCC1C(C(OC(=O)C(C(OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C

Names:
    CAS-1397-94-0
    NCGC00016578-01
    [(2R,3S,6S,7S,8R)-3-[(3-formamido-2-hydroxy-benzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl] 3-methylbutanoate

Registries:
    PubChem CID 6604296
    PubChem ID 11112483