(2E)-3-(4-[(1-(18-CYCLOHEXYL-9-OXO-3,8,11-TRIAZATETRACYCLO[9.7.0.0(2,7).0(12,17)]OCTADECA-1(18),2(7),3,5,12,14,16-HEPTAENE-14-AMIDO)CYCLOPENTANE)AMIDO]PHENYL)PROP-2-ENOIC ACID

CAS No.
877268-83-2
CCD No.
CCD04334233
Formula
C37 H37 N5 O5
MolWeight
631.729

Basic Information

Product Name: (2E)-3-(4-[(1-(18-CYCLOHEXYL-9-OXO-3,8,11-TRIAZATETRACYCLO[9.7.0.0(2,7).0(12,17)]OCTADECA-1(18),2(7),3,5,12,14,16-HEPTAENE-14-AMIDO)CYCLOPENTANE)AMIDO]PHENYL)PROP-2-ENOIC ACID
CAS: 877268-83-2
English Synonyms: (2E)-3-(4-[(1-(18-CYCLOHEXYL-9-OXO-3,8,11-TRIAZATETRACYCLO[9.7.0.0(2,7).0(12,17)]OCTADECA-1(18),2(7),3,5,12,14,16-HEPTAENE-14-AMIDO)CYCLOPENTANE)AMIDO]PHENYL)PROP-2-ENOIC ACID
MDL Number.: MFCD18633302
H bond acceptor: 10
H bond donor: 4
Smile: c1cc2c(nc1)-c3c(c4ccc(cc4n3CC(=O)N2)C(=O)NC5(CCCC5)C(=O)Nc6ccc(cc6)/C=C/C(=O)O)C7CCCCC7
InChi: InChI=1S/C37H37N5O5/c43-30-22-42-29-21-25(13-16-27(29)32(24-7-2-1-3-8-24)34(42)33-28(40-30)9-6-20-38-33)35(46)41-37(18-4-5-19-37)36(47)39-26-14-10-23(11-15-26)12-17-31(44)45/h6,9-17,20-21,24H,1-5,7-8,18-19,22H2,(H,39,47)(H,40,43)(H,41,46)(H,44,45)/b17-12+
InChiKey: InChIKey=JEPWKAPNFNIAPK-SFQUDFHCSA-N

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