Sincalide ammonium,70706-98-8-Amadis Chemical

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[CAS No.70706-98-8] A1036923 Sincalide ammonium 97%

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Catalog No.: A1036923

Cas No.: 70706-98-8

Molecular Formula: C₄₉H₆₅N₁₁O₁₆S₃

Molecular Weight: 1,160.30

MDL NO:

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Storage: Store in 2-8°C for long term (months)

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Smiles: S(C)CC[C@@H](C(N[C@H](C(N[C@H](C(N)=O)CC1C=CC=CC=1)=O)CC(=O)O)=O)NC([C@H](CC1=CNC2C=CC=CC1=2)NC(CNC([C@H](CCSC)NC([C@H](CC1C=CC(=CC=1)OS(=O)(=O)O)NC([C@H](CC(=O)O)N)=O)=O)=O)=O)=O.N

InchiKey: SKHSHPLUIPFDPM-ITZXPNBCSA-N

Inchi: InChI=1S/C49H62N10O16S3.H3N/c1-76-18-16-34(55-47(69)37(58-44(66)32(50)23-41(61)62)21-28-12-14-30(15-13-28)75-78(72,73)74)45(67)53-26-40(60)54-38(22-29-25-52-33-11-7-6-10-31(29)33)48(70)56-35(17-19-77-2)46(68)59-39(24-42(63)64)49(71)57-36(43(51)65)20-27-8-4-3-5-9-27;/h3-15,25,32,34-39,52H,16-24,26,50H2,1-2H3,(H2,51,65)(H,53,67)(H,54,60)(H,55,69)(H,56,70)(H,57,71)(H,58,66)(H,59,68)(H,61,62)(H,63,64)(H,72,73,74);1H3/t32-,34-,35-,36-,37-,38-,39-;/m0./s1

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Description [70706-98-8]

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