OCTREOTIDE ACETATE

pro_cas
50-56-6 ;79517-01-4 ;83150-76-9
pro_cdbregno
CCD00632386
pro_formula
C49 H66 N10 O10 S2 . C2 H4 O2
pro_molWeight
1079.3

basic_info

Product_Name: OCTREOTIDE ACETATE
CAS: 50-56-6 ;79517-01-4 ;83150-76-9
EnglishSynonyms: FCFWKTCT-OL (DISULFIDE BRIDGE: 2-7) ; PHENYLALANYLCYSTEINYLPHENYLALANYLTRYPTOPHYLLYSYLTHREONYL-N-[(2R,3R)-1,3-DIHYDROXY-2-BUTANYL]CYSTEINAMIDE ACETATE (1:2) ; OCTREOTIDE (ACETATE) ; OCTREOTIDE ; OCTREOTIDA ACETATE ; SANDOSTATINE ACETATE ; D-PHE-C[CYS-PHE-D-TRP-LYS-THR-CYS]-THR-OL ; SMS 201-995 ACETATE SALT ; OCTREOTODE ACETATE ; H-D-PHE-CYS-PHE-D-TRP-LYS-THR-CYS-L-THREONINOL ACETATE SALT ; OCTREOTIDE ACETATE ; H-D-PHE-CYS-PHE-D-TRP-LYS-THR-CYS-THR-OL (DISULFIDE BRIDGE: 2-7) ; DRG 0115 ACETATE ; D-PHE-CYS-PHE-D-TRP-LYS-THR-CYS-THR-OL ACETATE ; SANDOSTATIN ACETATE ; OCTREOTIDE ACETATE SALT ; OCTREOTIDE 98% ; OCTREOTIDUM ACETATE ; SMS 201-995 ACETATE ; LONGASTATIN ACETATE ; SANDOSTATIN ; SMS 201-995 ; D-PHENYLALANYL-L-CYSTEINYL-L-PHENYLALANYL-D-TRYPTOPHYL-L-LYSYL-L-THREONYL-N-[(1R,2R)-2-HYDROXY-1-(HYDROXYMETHYL)PROPYL]-L-CYSTEINAMIDE, CYCLIC (2-7)-DISULFIDE ; H-D-PHE-CYS-PHE-D-TRP-LYS-THR-CYS-L-THREONINOL ACETATE SALT (DISULFIDE BOND) ; (D-PHE5,CYS6.11,D-TRP8,L-THREONINOL12)-SOMATOSTATIN-14 (5-12) ACETATE SALT
pro_mdlNumber: MFCD08277638
pro_acceptors: 20
pro_donors: 13
pro_smile: C[C@H]([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)Cc4ccccc4)NC(=O)[C@@H](Cc5ccccc5)N)C(=O)N[C@H](CO)[C@@H](C)O)O.CC(=O)O
InChi: InChI=1S/C49H66N10O10S2.C2H4O2/c1-28(61)39(25-60)56-48(68)41-27-71-70-26-40(57-43(63)34(51)21-30-13-5-3-6-14-30)47(67)54-37(22-31-15-7-4-8-16-31)45(65)55-38(23-32-24-52-35-18-10-9-17-33(32)35)46(66)53-36(19-11-12-20-50)44(64)59-42(29(2)62)49(69)58-41;1-2(3)4/h3-10,13-18,24,28-29,34,36-42,52,60-62H,11-12,19-23,25-27,50-51H2,1-2H3,(H,53,66)(H,54,67)(H,55,65)(H,56,68)(H,57,63)(H,58,69)(H,59,64);1H3,(H,3,4)/t28-,29-,34-,36+,37+,38-,39-,40+,41+,42+;/m1./s1
InChiKey: InChIKey=XQEJFZYLWPSJOV-XJQYZYIXSA-N

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