Base information

Cat. No.
CAS No.7512-38-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C40H39N2NaO9S
Molecular Weight 746.8
Exact Mass 746.227
XLogP3 9.9218
Mr 196.875
PSA 197.52
Sequence -
Atom number 92
Bond number 95
Ring number 6
Rotor number 7
Residues number 0
Canonical smiles O=C1OC(c2c1cccc2)(c1cc(C(C)C)c(cc1C)O)c1cc(C(C)C)c(cc1C)O.Oc1ccc(c(c1)O)/N=N/c1ccc(cc1)S(=O)(=O)[O-].[Na+]

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