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- 9 of 9 defined stereocentres
5-Oxo-L-prolyl-L-histidyl-3-(1H-indol-2-yl)-L-alanyl-L-seryl-L-tyrosyl-D-leucyl-L-leucylarginyl-N-ethyl-L-prolinamide acetate (1:1)
CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc3cc4ccccc4[nH]3)NC(=O)[C@H](Cc5c[nH]cn5)NC(=O)[C@@H]6CCC(=O)N6.CC(=O)O
InChI=1S/C59H84N16O12.C2H4O2/c1-6-63-57(86)48-14-10-22-75(48)58(87)41(13-9-21-64-59(60)61)68-51(80)42(23-32(2)3)69-52(81)43(24-33(4)5)70-53(82)44(25-34-15-17-38(77)18-16-34)71-56(85)47(30-76)74-55(84)45(27-36-26-35-11-7-8-12-39(35)66-36)73-54(83)46(28-37-29-62-31-65-37)72-50(79)40-19-20-49(78)67-40;1-2(3)4/h7-8,11-12,15-18,26,29,31-33,40-48,66,76-77H,6,9-10,13-14,19-25,27-28,30H2,1-5H3,(H,62,65)(H,63,86)(H,67,78)(H,68,80)(H,69,81)(H,70,82)(H,71,85)(H,72,79)(H,73,83)(H,74,84)(H4,60,61,64);1H3,(H,3,4)/t40-,41-,42-,43+,44-,45-,46-,47-,48-;/m0./s1
YFDMUNOZURYOCP-XNHQSDQCSA-N
CSID:32702058, http://www.chemspider.com/Chemical-Structure.32702058.html (accessed 05:50, Apr 24, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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