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(S)-27-((2S,5S,11S,14R)-14-benzyl-11-(carboxymethyl)-5-(3-guanidinopropyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)-4,25-dioxo-2-((2-(((E)-(4-(trimethylstannyl)benzylidene)amino)oxy)acetamido)methyl)-6,9,12,15,18,21-hexaoxa-3,24-diazaheptacosan-1-oic acid

Catalog No. : KL-0600153-319

Cas No. : 600153-31-9

Standard English name : (S)-27-((2S,5S,11S,14R)-14-benzyl-11-(carboxymethyl)-5-(3-guanidinopropyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)-4,25-dioxo-2-((2-(((E)-(4-(trimethylstannyl)benzylidene)amino)oxy)acetamido)methyl)-6,9,12,15,18,21-hexaoxa-3,24-diazaheptacosan-1-oic acid

Molecular Formula : C₅₅H₈₄N₁₂O₁₉Sn

Molecular Weight : 1,336.03

MDL No. :

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Basic information

GHS
Smiles	O=C1N[C@@H](CCC(NCCOCCOCCOCCOCCOCCOCC(N[C@H](C(O)=O)CNC(CO/N=C/C2=CC=C([Sn](C)(C)C)C=C2)=O)=O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC1=CC=CC=C1
Inchi	InChI=1S/C52H75N12O19.3CH3.Sn/c53-52(54)56-15-7-12-37-47(71)58-32-43(66)60-40(29-46(69)70)50(74)64-39(28-35-8-3-1-4-9-35)49(73)63-38(48(72)62-37)13-14-42(65)55-16-17-77-18-19-78-20-21-79-22-23-80-24-25-81-26-27-82-33-45(68)61-41(51(75)76)31-57-44(67)34-83-59-30-36-10-5-2-6-11-36;;;;/h1,3-6,8-11,30,37-41H,7,12-29,31-34H2,(H,55,65)(H,57,67)(H,58,71)(H,60,66)(H,61,68)(H,62,72)(H,63,73)(H,64,74)(H,69,70)(H,75,76)(H4,53,54,56);3*1H3;/b59-30+;;;;/t37-,38-,39+,40-,41-;;;;/m0..../s1
InchiKey	UYRVIHBUTFAKRK-QGLBNYQBSA-N
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