Hitachimycin structure

Hitachimycin

16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione

Also Known As: Hitachimycin|Stubomycin|16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione

CAS: 77642-19-4
Molecular Formula C29H35NO5
Molecular Weight 477.25153 g/mol
LogP 4.0
Topological Polar Surface Area 95.9 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 477.25153
Monoisotopic Mass 477.25153
Heavy Atoms 35
Complexity 891.0

Chemical Identifiers

CAS Number 77642-19-4
SMILES CC1=CC2CC(C(=C2C(=O)CC(CCC=CCC(NC(=O)C=CC=C1)C3=CC=CC=C3)O)O)OC
InChIKey PLQKHNPZPRTISL-UHFFFAOYSA-N

Product Overview

Hitachimycin (CAS 77642-19-4), with molecular formula C29H35NO5 and molecular weight 477.25153 g/mol. IUPAC: 16,20-dihydroxy-21-methoxy-3-methyl-10-phenyl-9-azabicyclo[17.3.0]docosa-2,4,6,12,19-pentaene-8,18-dione.

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