basic_info |
|
| Product_Name: | H-D-PHE-CYS-TYR-D-TRP-LYS-VAL-CYS-TRP-NH2 (DISULFIDE BOND) ACETATE SALT |
| EnglishSynonyms: | VAPREOTIDE ACETATE SALT ; RC-160 ACETATE SALT ; H-D-PHE-CYS-TYR-D-TRP-LYS-VAL-CYS-TRP-NH2 (DISULFIDE BOND) ACETATE SALT |
| pro_mdlNumber: | MFCD18782447 |
| pro_acceptors: | 21 |
| pro_donors: | 13 |
| pro_smile: | CC(C)[C@H]1C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)Cc2c[nH]c3c2cccc3)Cc4ccc(cc4)O)NC(=O)[C@H](Cc5ccccc5)N)C(=O)N[C@@H](Cc6c[nH]c7c6cccc7)C(=O)N.CC(=O)O |
| InChi: | InChI=1S/C57H70N12O9S2.C2H4O2/c1-32(2)49-57(78)68-48(55(76)64-44(50(60)71)26-35-28-61-41-16-8-6-14-38(35)41)31-80-79-30-47(67-51(72)40(59)24-33-12-4-3-5-13-33)56(77)65-45(25-34-19-21-37(70)22-20-34)53(74)66-46(27-36-29-62-42-17-9-7-15-39(36)42)54(75)63-43(52(73)69-49)18-10-11-23-58;1-2(3)4/h3-9,12-17,19-22,28-29,32,40,43-49,61-62,70H,10-11,18,23-27,30-31,58-59H2,1-2H3,(H2,60,71)(H,63,75)(H,64,76)(H,65,77)(H,66,74)(H,67,72)(H,68,78)(H,69,73);1H3,(H,3,4)/t40-,43-,44-,45-,46-,47-,48-,49-;/m0./s1 |
| InChiKey: | InChIKey=KBIZSMHYSQUHDH-LRHHLYCKSA-N |
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