Base information

Cat. No.
CAS No.1088543-62-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C40H63N15O13
Molecular Weight 962.021
Exact Mass 961.473
XLogP3 -1.5112
Mr 265.654
PSA 458.3
Sequence -
Atom number 131
Bond number 133
Ring number 3
Rotor number 18
Residues number 0
Canonical smiles OC[C@@H]1NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C1=O)CCC2)CCC(=O)O)Cc1cnc[nH]1)CCC(=O)N)C(C)C

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