Try beta.chemspider
- 4 of 8 defined stereocentres
3-[(9S,12S,18S,21R)-9-(Carboxymethyl)-3,6,12,15,18-pentaisobutyl-25-(8-methylnonyl)-2,5,8,11,14,17,20,23-octaoxo-1-oxa-4,7,10,13,16,19,22-heptaazacyclopentacosan-21-yl]propanoic acid
CC(C)CCCCCCCC1CC(=O)N[C@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NC(CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)O1
InChI=1S/C52H91N7O13/c1-29(2)18-16-14-13-15-17-19-35-27-43(60)53-36(20-21-44(61)62)46(65)54-37(22-30(3)4)47(66)55-38(23-31(5)6)48(67)56-39(24-32(7)8)49(68)58-41(28-45(63)64)51(70)57-40(25-33(9)10)50(69)59-42(26-34(11)12)52(71)72-35/h29-42H,13-28H2,1-12H3,(H,53,60)(H,54,65)(H,55,66)(H,56,67)(H,57,70)(H,58,68)(H,59,69)(H,61,62)(H,63,64)/t35?,36-,37+,38?,39+,40?,41+,42?/m1/s1
QFZINZVLKJMTRW-PTCXZMPQSA-N
CSID:78445583, http://www.chemspider.com/Chemical-Structure.78445583.html (accessed 23:41, May 8, 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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