18-De-Glu-19-De-Ser-20,22-De-Gly-21-De-Leu-Atrial Natriuretic Factor (4-23)Nh2
[CAS# 111863-73-1]

Identification

• Name: 18-De-Glu-19-De-Ser-20,22-De-Gly-21-De-Leu-Atrial Natriuretic Factor (4-23)Nh2
• Synonyms: 3-Tyr-C-Anp; Anf (4-23)Nh2, Des-Gln(18)-Des-Ser(19)-Des-Gly(20,22)-Des-Leu(21)-; Anp (102-121), Des(Gln(116)-Ser(117)-Gly(118,120)-Leu(119))-
• Molecular Formula: C₆₄H₁₀₇N₂₅O₁₉S₂
• Molecular Weight: 1594.83
• CAS Registry Number: 111863-73-1
• SMILES: [C@@H]1([C@H](CC)C)NC([C@H](CCCNC(N)=N)NC([C@@H](NC([C@@H](NC([C@@H](NC(CNC(CNC([C@@H](NC([C@H](CSSC[C@H](NC([C@@H](NC(CNC1=O)=O)C)=O)C(N)=O)NC([C@@H](CO)NC([C@H](NC([C@@H](CCCNC(N)=N)N)=O)CO)=O)=O)=O)CC2=CC=CC=C2)=O)=O)=O)CCCNC(N)=N)=O)[C@H](CC)C)=O)CC(O)=O)=O)=O
• InChI: 1S/C64H107N25O19S2/c1-6-31(3)48-60(107)78-26-45(93)79-33(5)51(98)86-42(50(66)97)29-109-110-30-43(87-58(105)41(28-91)85-57(104)40(27-90)84-52(99)35(65)16-11-19-73-62(67)68)59(106)82-38(22-34-14-9-8-10-15-34)53(100)77-24-44(92)76-25-46(94)80-36(17-12-20-74-63(69)70)54(101)89-49(32(4)7-2)61(108)83-39(23-47(95)96)56(103)81-37(55(102)88-48)18-13-21-75-64(71)72/h8-10,14-15,31-33,35-43,48-49,90-91H,6-7,11-13,16-30,65H2,1-5H3,(H2,66,97)(H,76,92)(H,77,100)(H,78,107)(H,79,93)(H,80,94)(H,81,103)(H,82,106)(H,83,108)(H,84,99)(H,85,104)(H,86,98)(H,87,105)(H,88,102)(H,89,101)(H,95,96)(H4,67,68,73)(H4,69,70,74)(H4,71,72,75)/t31-,32-,33-,35+,36-,37-,38-,39-,40+,41+,42-,43-,48-,49-/m0/s1
• InChIKey: VDURFYRODPWWLV-GPMOFFLMSA-N