Novclobiocin 105
Molecular Formula:
C28H30ClNO10
InChI: InChI=1/C28H30ClNO10/c1-12(2)5-6-13-11-14(7-9-16(13)31)25(36)30-19-20(32)15-8-10-17(18(29)23(15)39-26(19)37)38-27-22(34)21(33)24(35)28(3,4)40-27/h5,7-11,21-22,24,27,31,33-35,37H,6H2,1-4H3,(H,30,36)/t21-,22+,24+,27+/m0/s1/f/h30H
InChIKey: InChIKey=VPSTVLNAFPQKLY-REKKOYELDB
SMILES: CC(=CCC1=C(C=CC(=C1)C(=O)NC2=C(OC3=C(C2=O)C=CC(=C3Cl)OC4C(C(C(C(O4)(C)C)O)O)O)O)O)C
Names:
C12472
Novclobiocin 105
N-[8-chloro-2-hydroxy-4-oxo-7-[(2S,3R,4S,5R)-3,4,5-trihydroxy-6,6-dimethyl-oxan-2-yl]oxy-chromen-3-yl]-4-hydroxy-3-(3-methylbut-2-enyl)benzamide
Registries:
PubChem CID 443857
PubChem ID 582862
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