Base information

Cat. No.
CAS No.623946-72-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C34H38N4O8
Molecular Weight 630.688
Exact Mass 630.269
XLogP3 0.5905
Mr 181.646
PSA 211.82
Sequence -
Atom number 84
Bond number 88
Ring number 5
Rotor number 10
Residues number 0
Canonical smiles OCC(c1/c/2=C/C3=N/C(=C\c4[nH]c(/C=C/5\N=C(/C=c(/c1C)\[nH]2)C(=C5C)C(CO)O)c(c4CCC(=O)O)C)/C(=C3C)CCC(=O)O)O

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