ORNIPRESSIN ACETATE ,3397-23-7 _Chemical Cloud Database

ORNIPRESSIN ACETATE

Basic Information
Product Name：	ORNIPRESSIN ACETATE
CAS：	3397-23-7
English Synonyms：	H-CYS-TYR-PHE-GLN-ASN-CYS-PRO-ORN-GLY-NH2 ACETATE ; ORNIPRESSIN ACETATE ; ORNIPRESSIN ACETATE/
MDL Number.：	MFCD10566643
H bond acceptor：	25
H bond donor：	13
Smile：	CC(=O)O.c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2)Cc3ccc(cc3)O)N)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N
InChi：	InChI=1S/C45H63N13O12S2.C2H4O2/c46-16-4-8-28(39(64)51-21-37(50)62)53-44(69)34-9-5-17-58(34)45(70)33-23-72-71-22-27(47)38(63)54-30(19-25-10-12-26(59)13-11-25)42(67)55-31(18-24-6-2-1-3-7-24)41(66)52-29(14-15-35(48)60)40(65)56-32(20-36(49)61)43(68)57-33;1-2(3)4/h1-3,6-7,10-13,27-34,59H,4-5,8-9,14-23,46-47H2,(H2,48,60)(H2,49,61)(H2,50,62)(H,51,64)(H,52,66)(H,53,69)(H,54,63)(H,55,67)(H,56,65)(H,57,68);1H3,(H,3,4)/t27-,28-,29-,30-,31-,32-,33-,34-;/m0./s1
InChiKey：	InChIKey=AYJSELDHDXYDKX-HPILINOVSA-N

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