PGLU-ASN-CYS[CYS]-PRO-ARG-GLY-NH2 ACETATE SALT

CAS No.
100930-16-3
CCD No.
CCD00064665
Formula
C28 H46 N12 O10 S2 . C2 H4 O2
MolWeight
834.929

Basic Information

Product Name: PGLU-ASN-CYS[CYS]-PRO-ARG-GLY-NH2 ACETATE SALT
CAS: 100930-16-3
English Synonyms: PGLU-ASN-CYS[CYS]-PRO-ARG-GLY-NH2 ACETATE SALT ; [PGLU4, (CYS2)6, ARG8]-VASOPRESSIN FRAGMENT 4-9 ACETATE SALT
MDL Number.: MFCD00133973
H bond acceptor: 22
H bond donor: 12
Smile: CC(=O)O.C1C[C@H](N(C1)C(=O)[C@H](CSSC[C@@H](C(=O)O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N
InChi: InChI=1S/C28H46N12O10S2.C2H4O2/c29-13(27(49)50)11-51-52-12-17(39-24(46)16(9-19(30)41)38-23(45)15-5-6-21(43)36-15)26(48)40-8-2-4-18(40)25(47)37-14(3-1-7-34-28(32)33)22(44)35-10-20(31)42;1-2(3)4/h13-18H,1-12,29H2,(H2,30,41)(H2,31,42)(H,35,44)(H,36,43)(H,37,47)(H,38,45)(H,39,46)(H,49,50)(H4,32,33,34);1H3,(H,3,4)/t13-,14-,15-,16-,17-,18-;/m0./s1
InChiKey: InChIKey=JCYUTVYWHXRGEB-ANMSZRTHSA-N

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