InChIKey | CUWHVWAQSSIDRB-BHONDUSNSA-N |
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Inchi | 1S/C41H58N12O8/c1-23(2)34(43)39(60)49-28(14-8-16-46-41(44)45)36(57)50-29(18-24-10-4-3-5-11-24)37(58)52-31(22-54)40(61)53-17-9-15-32(53)38(59)51-30(35(56)48-21-33(42)55)19-25-20-47-27-13-7-6-12-26(25)27/h3-7,10-13,20,23,28-32,34,47,54H,8-9,14-19,21-22,43H2,1-2H3,(H2,42,55)(H,48,56)(H,49,60)(H,50,57)(H,51,59)(H,52,58)(H4,44,45,46)/t28-,29-,30-,31-,32-,34-/m0/s1 |
SMILES | C(N)(=O)CNC(=O)[C@H](CC1C2=C(C=CC=C2)NC=1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C(C)C)N |
酸度系数(pKa) | 13.15±0.46(Predicted) |
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密度 | 1.45±0.1 g/cm3(Predicted) |