OVA323-339
C74H120N26O25
92915-79-2 Copyright (C) 2025 ACS
125126  0  0  1  0  0  0  0  0999 V2000
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124125  2  0  0  0  0
M  END
> <cas.rn>
92915-79-2

> <ca.index.name>
L-Arginine, L-isoleucyl-L-seryl-L-glutaminyl-L-alanyl-L-valyl-L-histidyl-L-alanyl-L-alanyl-L-histidyl-L-alanyl-L-α-glutamyl-L-isoleucyl-L-asparaginyl-L-α-glutamyl-L-alanylglycyl-

> <molecular.formula>
C74H120N26O25

> <smiles.canonical>
O=C(O)CCC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(N)C(C)CC)CO)CCC(=O)N)C)C(C)C)CC1=CN=CN1)C)C)CC2=CN=CN2)C)CCC(=O)O)C(C)CC)CC(=O)N)C(=O)NC(C(=O)NCC(=O)NC(C(=O)O)CCCNC(=N)N)C

> <smiles.isomeric>
[C@@H](CC1=CN=CN1)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H]([C@H](CC)C)N)=O)CO)=O)CCC(N)=O)=O)C)=O)[C@@H](C)C)=O)C(N[C@H](C(N[C@H](C(N[C@@H](CC2=CN=CN2)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(NCC(N[C@@H](CCCNC(=N)N)C(O)=O)=O)=O)C)=O)CCC(O)=O)=O)CC(N)=O)=O)[C@H](CC)C)=O)CCC(O)=O)=O)C)=O)=O)C)=O)C)=O

> <molecular.weight>
1773.91

> <density.predicted>
1.526±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
3.331±0.10    Most Acidic Temp: 25 °C

$$$$
