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RP-1

CAT: 0931-T80293-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T80293-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
239114-03-5
Target
Antibacterial
Related Pathways
Microbiology/Virology
Bioactivity
RP-1, an antimicrobial peptide, exhibits activity against a range of pathogens, including S. aureus, S. typhimurium, E. coli, and C. albicans [1].
Smiles
[C@@H](CC1=CC=CC=C1)(NC([C@@H](NC([C@@H](NC([C@H](CC2=CC=C(O)C=C2)NC([C@@H](NC([C@H](C)N)=O)CC(C)C)=O)=O)CCCCN)=O)CCCCN)=O)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(NCC(O)=O)=O)CC(C)C)=O)CCCNC(=N)N)=O)CCCCN)=O)CC(C)C)=O)CO)=O)CCCCN)=O)CC(C)C)=O)CC(C)C)=O)CCCCN)=O)CCCCN)=O)CCCCN)=O
Molecular Formula
C104H184N28O21
Molecular Weight
2162.75
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

H-Ala-Leu-Tyr-Lys-Lys-Phe-Lys-Lys-Lys-Leu-Leu-Lys-Ser-Leu-Lys-Arg-Leu-Gly-OH
CAS Number239114-03-5
PubChem CID16142343
IUPAC Name2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-methylpentanoyl]amino]acetic acid
Molecular FormulaC104H184N28O21
Molecular Weight2162.7
XLogP-1.8
Topological Polar Surface Area843
Hydrogen Bond Donor Count31
Hydrogen Bond Acceptor Count30
Rotatable Bond Count83
Heavy Atom Count153
Formal Charge0
Complexity4180
SMILES
C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)N
InChI
InChI=1S/C104H184N28O21/c1-61(2)52-78(88(138)116-59-86(135)136)126-95(145)77(39-29-51-115-104(113)114)120-92(142)71(33-16-23-45-106)121-98(148)81(55-64(7)8)129-103(153)85(60-133)132-96(146)76(38-21-28-50-111)122-97(147)80(54-63(5)6)128-100(150)82(56-65(9)10)127-93(143)74(36-19-26-48-109)118-89(139)70(32-15-22-44-105)117-90(140)72(34-17-24-46-107)123-101(151)83(57-67-30-13-12-14-31-67)130-94(144)75(37-20-27-49-110)119-91(141)73(35-18-25-47-108)124-102(152)84(58-68-40-42-69(134)43-41-68)131-99(149)79(53-62(3)4)125-87(137)66(11)112/h12-14,30-31,40-43,61-66,70-85,133-134H,15-29,32-39,44-60,105-112H2,1-11H3,(H,116,138)(H,117,140)(H,118,139)(H,119,141)(H,120,142)(H,121,148)(H,122,147)(H,123,151)(H,124,152)(H,125,137)(H,126,145)(H,127,143)(H,128,150)(H,129,153)(H,130,144)(H,131,149)(H,132,146)(H,135,136)(H4,113,114,115)/t66-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-/m0/s1
InChIKey
YPEZFJIJXAHNQO-QZBHXIFBSA-N
Chemical Structure
2D Structure
2D structure of H-Ala-Leu-Tyr-Lys-Lys-Phe-Lys-Lys-Lys-Leu-Leu-Lys-Ser-Leu-Lys-Arg-Leu-Gly-OH
CAS: 239114-03-5
CID: 16142343
Formula: C104H184N28O21
MW: 2162.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight2162.7
XLogP3-1.8
Hydrogen Bond Donor Count31
Hydrogen Bond Acceptor Count30
Rotatable Bond Count83
Exact Mass2162.42243983
Monoisotopic Mass2161.41908499
Topological Polar Surface Area843 Ų
Heavy Atom Count153
Formal Charge0
Complexity4180
Isotope Atom Count0
Defined Atom Stereocenter Count17
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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