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G12

CAT: 0931-T39099-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T39099-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
162550-82-5
Target
Ras
Related Pathways
MAPK
Bioactivity
G12 (Ras 5-17) is a wild-type Ras peptide comprising amino acids 5-17, specifically KLVVVGAGGVGKS, and serves as a control in studies investigating mutant Ras peptides such as V12.
Smiles
CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(O)=O |@:26,@@:57|
Molecular Formula
C52H95N15O15
Molecular Weight
1170.422
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

H-Lys-Leu-Val-Val-Val-Gly-Ala-Gly-Gly-Val-Gly-Lys-Ser-OH
CAS Number162550-82-5
PubChem CID168013134
IUPAC Name(2S)-2-[[(2S)-6-amino-2-[[2-[[(2S)-2-[[2-[[2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]-3-methylbutanoyl]amino]acetyl]amino]hexanoyl]amino]-3-hydroxypropanoic acid
Molecular FormulaC52H95N15O15
Molecular Weight1170.4
XLogP-4
Topological Polar Surface Area485
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count18
Rotatable Bond Count40
Heavy Atom Count82
Formal Charge0
Complexity2150
SMILES
C[C@@H](C(=O)NCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)N
InChI
InChI=1S/C52H95N15O15/c1-26(2)20-34(62-45(74)32(55)16-12-14-18-53)47(76)65-42(29(7)8)50(79)67-43(30(9)10)51(80)66-41(28(5)6)49(78)58-23-37(70)60-31(11)44(73)57-21-36(69)56-22-39(72)64-40(27(3)4)48(77)59-24-38(71)61-33(17-13-15-19-54)46(75)63-35(25-68)52(81)82/h26-35,40-43,68H,12-25,53-55H2,1-11H3,(H,56,69)(H,57,73)(H,58,78)(H,59,77)(H,60,70)(H,61,71)(H,62,74)(H,63,75)(H,64,72)(H,65,76)(H,66,80)(H,67,79)(H,81,82)/t31-,32-,33-,34-,35-,40-,41-,42-,43-/m0/s1
InChIKey
LFBYNUOKDPTBGM-ZOGIGDDCSA-N
Chemical Structure
2D Structure
2D structure of H-Lys-Leu-Val-Val-Val-Gly-Ala-Gly-Gly-Val-Gly-Lys-Ser-OH
CAS: 162550-82-5
CID: 168013134
Formula: C52H95N15O15
MW: 1170.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1170.4
XLogP3-4
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count18
Rotatable Bond Count40
Exact Mass1169.71320738
Monoisotopic Mass1169.71320738
Topological Polar Surface Area485 Ų
Heavy Atom Count82
Formal Charge0
Complexity2150
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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