Try beta.chemspider
- 7 of 7 defined stereocentres
(2S,5S,8S,11S,14S,17S,20S)-11-(2-Amino-2-oxoethyl)-8-benzyl-14-(2-carboxyethyl)-17-(4-hydroxybenzyl)-2-(hydroxymethyl)-5-(1H-imidazol-5-ylmethyl)-3,6,9,12,15,18,23-heptaoxo-1,4,7,10,13,16,19-heptaazac yclotricosane-20-carboxylic acid
c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N2)Cc3cnc[nH]3)CO)C(=O)O)Cc4ccc(cc4)O)CCC(=O)O)CC(=O)N
InChI=1S/C41H50N10O14/c42-32(54)17-30-39(62)46-25(11-13-34(56)57)35(58)48-28(15-22-6-8-24(53)9-7-22)36(59)47-26(41(64)65)10-12-33(55)45-31(19-52)40(63)50-29(16-23-18-43-20-44-23)38(61)49-27(37(60)51-30)14-21-4-2-1-3-5-21/h1-9,18,20,25-31,52-53H,10-17,19H2,(H2,42,54)(H,43,44)(H,45,55)(H,46,62)(H,47,59)(H,48,58)(H,49,61)(H,50,63)(H,51,60)(H,56,57)(H,64,65)/t25-,26-,27-,28-,29-,30-,31-/m0/s1
NKJDLNKTWBLVMS-XIJWKTHWSA-N
CSID:392926, http://www.chemspider.com/Chemical-Structure.392926.html (accessed 01:45, Apr 27, 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
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