Sacromycin

Molecular Formula: C29H42N6O9


InChI: InChI=1/C29H42N6O9/c1-15-19(44-26-24(38)23(37)22(34(4)5)16(2)43-26)10-11-21(42-15)35-13-12-20(33-28(35)41)32-25(39)17-6-8-18(9-7-17)31-27(40)29(3,30)14-36/h6-9,12-13,15-16,19,21-24,26,36-38H,10-11,14,30H2,1-5H3,(H,31,40)(H,32,33,39,41)/t15-,16-,19+,21-,22-,23+,24-,26-,29+/m1/s1/f/h31-32H

InChIKey: InChIKey=HDNVYHWHCVTDIV-XZEVXMIUDW
SMILES: CC1C(CCC(O1)N2C=CC(=NC2=O)NC(=O)C3=CC=C(C=C3)NC(=O)C(C)(CO)N)OC4C(C(C(C(O4)C)N(C)C)O)O

Names:
    Allomycin (VAN)
    Allomycin
    AMICETIN
    Amicetin (VAN)
    Amicetin-A
    BRN 0102092
    D-13
    NSC 5340
    Sacromycin (VAN)
    Sacromycin
    4-[[(2S)-2-amino-3-hydroxy-2-methyl-propanoyl]amino]-N-[1-[(2R,5S,6R)-5-[(2R,3R,4S,5S,6R)-5-dimethylamino-3,4-dihydroxy-6-methyl-oxan-2-yl]oxy-6-methyl-oxan-2-yl]-2-oxo-pyrimidin-4-yl]benzamide

Registries:
    PubChem CID 28675
    PubChem ID 171111