VAPREOTIDE ACETATE

CAS No.
103222-11-3 ;116430-60-5
CCD No.
CCD02195309
Formula
C57 H71 N13 O8 S2 . C2 H4 O2
MolWeight
1190.45

Basic Information

Product Name: VAPREOTIDE ACETATE
CAS: 103222-11-3 ;116430-60-5
English Synonyms: RC 160 ACETATE ; D-PHE-CYS-TRP-D-TRP-LYS-VAL-CYS-TRP-CONH2(DISULFIDE CYS2-CYS7)ACETATE ; VAPREOTIDA ACETATE ; VAPREOTIDE ACETATE ; OCTASTATIN ACETATE ; VAPREOTIDE ; DB04894 ACETATE
MDL Number.: MFCD14155633
H bond acceptor: 21
H bond donor: 14
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(=N)N.CC(=O)O
InChi: InChI=1S/C57H71N13O8S2.C2H4O2/c1-32(2)49-57(78)69-48(55(76)65-44(50(60)61)26-35-28-62-41-16-8-6-14-38(35)41)31-80-79-30-47(68-51(72)40(59)24-33-12-4-3-5-13-33)56(77)66-45(25-34-19-21-37(71)22-20-34)53(74)67-46(27-36-29-63-42-17-9-7-15-39(36)42)54(75)64-43(52(73)70-49)18-10-11-23-58;1-2(3)4/h3-9,12-17,19-22,28-29,32,40,43-49,62-63,71H,10-11,18,23-27,30-31,58-59H2,1-2H3,(H3,60,61)(H,64,75)(H,65,76)(H,66,77)(H,67,74)(H,68,72)(H,69,78)(H,70,73);1H3,(H,3,4)/t40-,43+,44+,45+,46-,47+,48-,49+;/m1./s1
InChiKey: InChIKey=SYFKYHQCJSOOCM-QQRNVDBGSA-N

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