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- 1 of 7 defined stereocentres
4-[(9S)-9-{5-Chloro-2-[(2-methylbenzyl)oxy]phenyl}-6,13,15-trioxo-3,7-dithia-5,14-diazapentacyclo[9.5.1.0~2,10~.0~4,8~.0~12,16~]heptadec-4(8)-en-14-yl]butanoic acid
Cc1ccccc1COc2ccc(cc2[C@H]3c4c([nH]c(=O)s4)SC5C3C6CC5C7C6C(=O)N(C7=O)CCCC(=O)O)Cl
InChI=1S/C31H29ClN2O6S2/c1-14-5-2-3-6-15(14)13-40-20-9-8-16(32)11-17(20)22-23-18-12-19(26(23)41-28-27(22)42-31(39)33-28)25-24(18)29(37)34(30(25)38)10-4-7-21(35)36/h2-3,5-6,8-9,11,18-19,22-26H,4,7,10,12-13H2,1H3,(H,33,39)(H,35,36)/t18?,19?,22-,23?,24?,25?,26?/m1/s1
CFHNFLVYBKKMAD-FRFRNXBGSA-N
CSID:12203778, http://www.chemspider.com/Chemical-Structure.12203778.html (accessed 11:20, 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
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