AC1NS5R9

3-methyl-8-(octyliminomethyl)-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(octyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol

Also Known As: (1E)-7-[(8Z)-1,6-dihydroxy-3-methyl-8-[(octylamino)methylide|(8Z,8'E)-1,1',6,6'-Tetrahydroxy-3,3'-dimethyl-8,8'-bis[(octylamino)methylidene]-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-7,7'(8H,8'H)-dione|3-Methyl-8-(octyliminomethyl)-5-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(octyliminomethyl)-5-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol|7-[1,6-dihydroxy-3-methyl-8-[(octylamino)methylidene]-7-oxo-5-propan-2-ylnaphthalen-2-yl]-3,8-dihydroxy-6-methyl-1-[(octylamino)methylidene]-4-propan-2-ylnaphthalen-2-one

Molecular Formula	C46H64N2O6
Molecular Weight	740.47644 g/mol
LogP	12.9
Topological Polar Surface Area	146.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	8
Rotatable Bonds	19
Exact Mass	740.47644
Monoisotopic Mass	740.47644
Heavy Atoms	54
Complexity	1050.0

Chemical Identifiers

CAS Number	6329-83-5
SMILES	CCCCCCCCN=CC1=C(C(=C(C2=C1C(=C(C(=C2)C)C3=C(C4=C(C=C3C)C(=C(C(=C4C=NCCCCCCCC)O)O)C(C)C)O)O)C(C)C)O)O
InChIKey	LSKOYFQDNAXMIY-UHFFFAOYSA-N