(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid
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![(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bb997770a42e40e69eb860b31013c5bb.png "(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid")
(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid
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CAS No:
133525-11-8
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Formula:
C23H39N9O10
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Chemical Name:
(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid
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Synonyms:
Me-Gly-Arg-Gly-Asp-Ser-Pro;N-Me-GRGDSP;N-methylglycyl-arginyl-glycyl-aspartyl-seryl-proline;133525-11-8;N-Methylglycyl-arginyl-glycyl-aspartyl-seryl-proline;N-Me-Grgdsp;(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid;Me-Gly-arg-gly-asp-ser-pro;Sar-Arg-Gly-Asp-Ser-Pro-OH;SCHEMBL8382696;DTXSID20928176;ZINC100098838;(S)-1-((6S,12S,15S)-12-(Carboxymethyl)-6-(3-guanidinopropyl)-15-(hydroxymethyl)-4,7,10,13-tetraoxo-2,5,8,11,14-pentaazahexadecan-16-oyl)pyrrolidine-2-carboxylic acid;(S)-1-((6S,12S,15S)-12-(carboxymethyl)-6-(3-guanidinopropyl)-15-(hydroxymethyl)-4,7,10,13-tetraoxo-2,5,8,11,14-pentaazahexadecane)pyrrolidine-2-carboxylic acid;N-[6-(3-Carbamimidamidopropyl)-12-(carboxymethyl)-4,7,10,13-tetrahydroxy-2,5,8,11-tetraazatrideca-4,7,10-trien-13-ylidene]serylproline
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CAS No:
(2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]acetyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid Basic Attributes
601.6 g/mol
601.28198847 g/mol
Computed Properties
Molecular Weight:601.6
XLogP3:-7.4
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:18
Exact Mass:601.28198847
Monoisotopic Mass:601.28198847
Topological Polar Surface Area:308
Heavy Atom Count:42
Complexity:1030
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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