- 8 of 8 defined stereocentres
1,1'-{2,4-Hexadiyne-1,6-diylbis[oxy{(2S,3R)-2-[(N-methyl-L-alanyl)amino]-1-oxo-3,1-butanediyl}(2S)-1,2-pyrrolidinediylmethylene]}bis[5-(phenylsulfanyl)-1H-tetrazole]
O=C(N3[C@H](Cn2nnnc2Sc1ccccc1)CCC3)[C@@H](NC(=O)[C@@H](NC)C)[C@H](OCC#CC#CCO[C@H](C)[C@H](NC(=O)[C@@H](NC)C)C(=O)N4CCC[C@H]4Cn6nnnc6Sc5ccccc5)C
InChI=1S/C46H60N14O6S2/c1-31(47-5)41(61)49-39(43(63)57-25-17-19-35(57)29-59-45(51-53-55-59)67-37-21-11-9-12-22-37)33(3)65-27-15-7-8-16-28-66-34(4)40(50-42(62)32(2)48-6)44(64)58-26-18-20-36(58)30-60-46(52-54-56-60)68-38-23-13-10-14-24-38/h9-14,21-24,31-36,39-40,47-48H,17-20,25-30H2,1-6H3,(H,49,61)(H,50,62)/t31-,32-,33+,34+,35-,36-,39-,40-/m0/s1
CDUYVSXKBIKUNH-RAUIGOKHSA-N
CSID:5293978, http://www.chemspider.com/Chemical-Structure.5293978.html (accessed 06:09, Apr 19, 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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