Basic Information |
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Product Name: | TCY-NH2 |
CAS: | 327177-34-4 |
English Synonyms: | TCY-NH2 ; TRANS-CINNAMOYL-YPGKF-AMIDE ; TRANS-CINNAMOYL-TYR-PRO-GLY-LYS-PHE-NH2 ; (TRANS-CINNAMOYL)-YPGKF-NH2 |
MDL Number.: | MFCD06798369 |
H bond acceptor: | 14 |
H bond donor: | 7 |
Smile: | c1ccc(cc1)C[C@@H](C(=O)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc3ccc(cc3)O)NC(=O)/C=C/c4ccccc4 |
InChi: | InChI=1S/C40H49N7O7/c41-22-8-7-14-31(38(52)46-32(37(42)51)24-28-12-5-2-6-13-28)44-36(50)26-43-39(53)34-15-9-23-47(34)40(54)33(25-29-16-19-30(48)20-17-29)45-35(49)21-18-27-10-3-1-4-11-27/h1-6,10-13,16-21,31-34,48H,7-9,14-15,22-26,41H2,(H2,42,51)(H,43,53)(H,44,50)(H,45,49)(H,46,52)/b21-18+/t31-,32-,33-,34-/m0/s1 |
InChiKey: | InChIKey=XKRAKQXQVIGYQC-PHOSSJRVSA-N |
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