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Friulimicin C

CAT: 0013-GTR19255502-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255502-01Size:10 mg
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Description
Friulimicin C is a lipopeptide antibiotic known for its activity in inhibiting peptidoglycan synthesis.
CAS Number
302327-41-9
Field of Research
Infectious Disease & Virology
Smiles
O=C1N2[C@@] (C (=O) N[C@@] ([C@@H] (C (O) =O) C) (C (=O) N[C@@H] (CC (O) =O) C (=O) NCC (=O) N[C@@H] (CC (O) =O) C (=O) NCC (=O) N[C@] ([C@@H] (C) N) (C (=O) N[C@@H] (C (C) C) C (=O) N3[C@] (C (=O) N[C@H] (C) [C@@H]1NC ([C@@H] (NC (C/C=C\CCCCCC (CC) C) =O) CC (N) =O) =O) (CCC3) [H]) [H]) [H]) (CCCC2) [H]
Molecular Formula
C58H92N14O19
Molecular Weight
1289.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Friulimicin C

Friulimicin C is an oligopeptide.

CAS Number302327-41-9
PubChem CID139585781
IUPAC Name2-[16-(1-aminoethyl)-3-[[4-amino-2-[[(E)-10-methyldodec-3-enoyl]amino]-4-oxobutanoyl]amino]-22,28-bis(carboxymethyl)-4-methyl-2,6,12,15,18,21,24,27,30,33-decaoxo-13-propan-2-yl-1,5,11,14,17,20,23,26,29,32-decazatricyclo[32.4.0.07,11]octatriacontan-31-yl]propanoic acid
Molecular FormulaC58H92N14O19
Molecular Weight1289.4
XLogP-3.5
Topological Polar Surface Area513
Hydrogen Bond Donor Count15
Hydrogen Bond Acceptor Count20
Rotatable Bond Count22
Heavy Atom Count91
Formal Charge0
Complexity2710
SMILES
CCC(C)CCCCC/C=C/CC(=O)NC(CC(=O)N)C(=O)NC1C(NC(=O)C2CCCN2C(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C3CCCCN3C1=O)C(C)C(=O)O)CC(=O)O)CC(=O)O)C(C)N)C(C)C)C
InChI
InChI=1S/C58H92N14O19/c1-8-30(4)18-13-11-9-10-12-14-21-40(74)64-34(24-39(60)73)51(83)70-48-33(7)63-52(84)38-20-17-23-72(38)56(88)45(29(2)3)68-55(87)47(32(6)59)67-42(76)28-62-49(81)35(25-43(77)78)65-41(75)27-61-50(82)36(26-44(79)80)66-54(86)46(31(5)58(90)91)69-53(85)37-19-15-16-22-71(37)57(48)89/h12,14,29-38,45-48H,8-11,13,15-28,59H2,1-7H3,(H2,60,73)(H,61,82)(H,62,81)(H,63,84)(H,64,74)(H,65,75)(H,66,86)(H,67,76)(H,68,87)(H,69,85)(H,70,83)(H,77,78)(H,79,80)(H,90,91)/b14-12+
InChIKey
MDBSKEKVSGDWLT-WYMLVPIESA-N
Chemical Structure
2D Structure
2D structure of Friulimicin C
CAS: 302327-41-9
CID: 139585781
Formula: C58H92N14O19
MW: 1289.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1289.4
XLogP3-3.5
Hydrogen Bond Donor Count15
Hydrogen Bond Acceptor Count20
Rotatable Bond Count22
Exact Mass1288.66631676
Monoisotopic Mass1288.66631676
Topological Polar Surface Area513 Ų
Heavy Atom Count91
Formal Charge0
Complexity2710
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count13
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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