Try beta.chemspider
- 4 of 4 defined stereocentres
Methyl hydrogen {(2S)-1-[(2S)-2-(5-{4-[5-(2-{(2S)-1-[(2R)-2-{(E)-[hydroxy(methoxy)methylene]amino}-2-phenylacetyl]-2-pyrrolidinyl}-1H-benzimidazol-6-yl)thieno[3,2-b]thiophen-2-yl]phenyl}-1H-imidazol-2 -yl)-1-pyrrolidinyl]-3-methyl-1-oxo-2-butanyl}carbonimidate
CC(C)[C@@H](C(=O)N1CCC[C@H]1c2[nH]c(cn2)c3ccc(cc3)c4cc5c(s4)cc(s5)c6ccc7c(c6)[nH]c(n7)[C@@H]8CCCN8C(=O)[C@@H](c9ccccc9)/N=C(\O)/OC)/N=C(\O)/OC
InChI=1S/C47H48N8O6S2/c1-26(2)40(52-46(58)60-3)44(56)54-20-8-12-34(54)42-48-25-33(51-42)27-14-16-28(17-15-27)36-23-38-39(62-36)24-37(63-38)30-18-19-31-32(22-30)50-43(49-31)35-13-9-21-55(35)45(57)41(53-47(59)61-4)29-10-6-5-7-11-29/h5-7,10-11,14-19,22-26,34-35,40-41H,8-9,12-13,20-21H2,1-4H3,(H,48,51)(H,49,50)(H,52,58)(H,53,59)/t34-,35-,40-,41+/m0/s1
IESVENFHVYJXLX-UNQNYZJASA-N
CSID:65323042, http://www.chemspider.com/Chemical-Structure.65323042.html (accessed 20:01, Apr 29, 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
Click to predict properties on the Chemicalize site
Advertisement
Spotlight