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M918

CAT: 0931-TP2738-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TP2738-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
955937-87-8
Bioactivity
M918 is a cell-penetrating peptide that is internalized by cells via endocytosis. It effectively penetrates various cell types in a non-toxic manner. M918 is utilized in research for gene therapy and drug delivery systems.
Smiles
C(=O)(N1[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](C(C)C)C(N)=O)=O)CCCNC(=N)N)=O)C(C)C)=O)CCCNC(=N)N)=O)CCC1)[C@H]2N(C(CNC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CC3=CC=CC=C3)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CCSC)N)=O)C(C)C)=O)[C@@H](C)O)=O)C(C)C)=O)CC(C)C)=O)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)CC(C)C)=O)CCCNC(=N)N)=O)[C@H](CC)C)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)C)=O)CS)=O)=O)CCC2
Molecular Formula
C116H208N44O23S2
Molecular Weight
2651.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

L-Valinamide, L-methionyl-L-valyl-L-threonyl-L-valyl-L-leucyl-L-phenylalanyl-L-arginyl-L-arginyl-L-leucyl-L-arginyl-L-isoleucyl-L-arginyl-L-arginyl-L-alanyl-L-cysteinylglycyl-L-prolyl-L-prolyl-L-arginyl-L-valyl-L-arginyl-
CAS Number955937-87-8
PubChem CID172653503
IUPAC Name(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]-1-[(2S)-1-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-sulfanylpropanoyl]amino]acetyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
Molecular FormulaC116H208N44O23S2
Molecular Weight2651.3
XLogP-2.9
Topological Polar Surface Area1140
Hydrogen Bond Donor Count44
Hydrogen Bond Acceptor Count33
Rotatable Bond Count93
Heavy Atom Count185
Formal Charge0
Complexity5780
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C(C)C)C(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCSC)N
InChI
InChI=1S/C116H208N44O23S2/c1-18-64(14)87(157-99(173)73(37-26-47-137-114(127)128)145-100(174)76(53-58(2)3)149-96(170)71(35-24-45-135-112(123)124)143-94(168)70(34-23-44-134-111(121)122)144-102(176)78(55-67-31-20-19-21-32-67)150-101(175)77(54-59(4)5)151-105(179)85(62(10)11)156-108(182)88(66(16)161)158-106(180)86(63(12)13)154-91(165)68(117)42-52-185-17)107(181)148-72(36-25-46-136-113(125)126)95(169)142-69(33-22-43-133-110(119)120)93(167)141-65(15)90(164)152-79(57-184)92(166)140-56-82(162)159-50-30-41-81(159)109(183)160-51-29-40-80(160)103(177)146-74(38-27-48-138-115(129)130)98(172)155-84(61(8)9)104(178)147-75(39-28-49-139-116(131)132)97(171)153-83(60(6)7)89(118)163/h19-21,31-32,58-66,68-81,83-88,161,184H,18,22-30,33-57,117H2,1-17H3,(H2,118,163)(H,140,166)(H,141,167)(H,142,169)(H,143,168)(H,144,176)(H,145,174)(H,146,177)(H,147,178)(H,148,181)(H,149,170)(H,150,175)(H,151,179)(H,152,164)(H,153,171)(H,154,165)(H,155,172)(H,156,182)(H,157,173)(H,158,180)(H4,119,120,133)(H4,121,122,134)(H4,123,124,135)(H4,125,126,136)(H4,127,128,137)(H4,129,130,138)(H4,131,132,139)/t64-,65-,66+,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,83-,84-,85-,86-,87-,88-/m0/s1
InChIKey
JMTTVIHMOJZQIW-KOOAKDNOSA-N
Chemical Structure
2D Structure
2D structure of L-Valinamide, L-methionyl-L-valyl-L-threonyl-L-valyl-L-leucyl-L-phenylalanyl-L-arginyl-L-arginyl-L-leucyl-L-arginyl-L-isoleucyl-L-arginyl-L-arginyl-L-alanyl-L-cysteinylglycyl-L-prolyl-L-prolyl-L-arginyl-L-valyl-L-arginyl-
CAS: 955937-87-8
CID: 172653503
Formula: C116H208N44O23S2
MW: 2651.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight2651.3
XLogP3-2.9
Hydrogen Bond Donor Count44
Hydrogen Bond Acceptor Count33
Rotatable Bond Count93
Exact Mass2650.5933962
Monoisotopic Mass2649.5900414
Topological Polar Surface Area1140 Ų
Heavy Atom Count185
Formal Charge0
Complexity5780
Isotope Atom Count0
Defined Atom Stereocenter Count23
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19063677-01M918
CRB1100287-01[5-FAM]-M918
CRB1100287-01[5-FAM]-M918 - (Fluorescent Peptides)

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