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Human milk lysozyme

CAT: 0804-HY-P3021-01Size: 100 mgDry Ice: YesHazardous: No
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CAT#:0804-HY-P3021-01Size:100 mg
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Description
Human milk lysozyme is the lysozyme found in human milk. Human milk lysozyme is thought to be a key defense factor in protecting the gastrointestinal tract of newborns against bacterial infection[1].
CAS Number
12671-19-1
UNSPSC
12352204
Target
Bacterial; Biochemical Assay Reagents
Type
Enzyme
Related Pathways
Anti-infection; Others
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/human-milk-lysozyme.html
Purity
98.00
Solubility
H2O
Smiles
[Humanmilklysozyme]
References & Citations
[1]Ibrahim HR, et al. Human lysozyme possesses novel antimicrobial peptides within its N-terminal domain that target bacterial respiration. J Agric Food Chem. 2011 Sep 28;59 (18) :10336-45.
Shipping Conditions
Dry Ice
Storage Conditions
Store at -80°C for 2 years
Scientific Category
Enzyme
Clinical Information
No Development Reported

Chemical Information

2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[[1-[2-[[2-[[2-[[2-[(2-amino-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-3-carboxypropanoyl]pyrrolidin-2-yl]-hydroxymethylidene]amino]-1,5-dihydroxy-5-iminopentylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1,4-dihydroxy-4-iminobutylidene]amino]-5-carbamimidamidopentanoic acid

See also: Lysozyme (preferred).

CAS Number12671-19-1
PubChem CID170842556
IUPAC Name2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[[1-[2-[[2-[[2-[[2-[(2-amino-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-3-carboxypropanoyl]pyrrolidin-2-yl]-hydroxymethylidene]amino]-1,5-dihydroxy-5-iminopentylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1,4-dihydroxy-4-iminobutylidene]amino]-5-carbamimidamidopentanoic acid
Molecular FormulaC99H159N37O23
Molecular Weight2235.6
XLogP2.5
Topological Polar Surface Area1070
Hydrogen Bond Donor Count40
Hydrogen Bond Acceptor Count47
Rotatable Bond Count75
Heavy Atom Count159
Formal Charge0
Complexity5300
SMILES
CCC(C)C(C(=NC(CCCNC(=N)N)C(=NC(C)C(=NC(CC1=CNC2=CC=CC=C21)C(=NC(C(C)C)C(=NC(C)C(=NC(CC3=CNC4=CC=CC=C43)C(=NC(CCCNC(=N)N)C(=NC(CC(=N)O)C(=NC(CCCNC(=N)N)C(=O)O)O)O)O)O)O)O)O)O)O)N=C(CN=C(C(CCC(=N)O)N=C(C5CCCN5C(=O)C(CC(=O)O)N=C(C(CCCNC(=N)N)N=C(C(C(C)C)N=C(C(C(C)C)N=C(C(CCCNC(=N)N)N)O)O)O)O)O)O)O
InChI
InChI=1S/C99H159N37O23/c1-11-50(8)77(132-72(139)46-120-81(145)63(32-33-70(101)137)124-88(152)69-31-21-39-136(69)93(157)68(43-73(140)141)131-84(148)62(29-19-37-116-98(109)110)125-90(154)75(48(4)5)135-91(155)76(49(6)7)133-80(144)57(100)24-16-34-113-95(103)104)92(156)126-60(27-17-35-114-96(105)106)82(146)121-51(9)78(142)129-66(41-54-45-119-59-26-15-13-23-56(54)59)87(151)134-74(47(2)3)89(153)122-52(10)79(143)128-65(40-53-44-118-58-25-14-12-22-55(53)58)85(149)123-61(28-18-36-115-97(107)108)83(147)130-67(42-71(102)138)86(150)127-64(94(158)159)30-20-38-117-99(111)112/h12-15,22-23,25-26,44-45,47-52,57,60-69,74-77,118-119H,11,16-21,24,27-43,46,100H2,1-10H3,(H2,101,137)(H2,102,138)(H,120,145)(H,121,146)(H,122,153)(H,123,149)(H,124,152)(H,125,154)(H,126,156)(H,127,150)(H,128,143)(H,129,142)(H,130,147)(H,131,148)(H,132,139)(H,133,144)(H,134,151)(H,135,155)(H,140,141)(H,158,159)(H4,103,104,113)(H4,105,106,114)(H4,107,108,115)(H4,109,110,116)(H4,111,112,117)
InChIKey
ZJCXKXFAOCLSRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[[1-[2-[[2-[[2-[[2-[(2-amino-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-3-carboxypropanoyl]pyrrolidin-2-yl]-hydroxymethylidene]amino]-1,5-dihydroxy-5-iminopentylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxypropylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]-5-carbamimidamido-1-hydroxypentylidene]amino]-1,4-dihydroxy-4-iminobutylidene]amino]-5-carbamimidamidopentanoic acid
CAS: 12671-19-1
CID: 170842556
Formula: C99H159N37O23
MW: 2235.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight2235.6
XLogP32.5
Hydrogen Bond Donor Count40
Hydrogen Bond Acceptor Count47
Rotatable Bond Count75
Exact Mass2235.2443093
Monoisotopic Mass2234.2409545
Topological Polar Surface Area1070 Ų
Heavy Atom Count159
Formal Charge0
Complexity5300
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count18
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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