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Phoslactomycin A

CAT: 0931-TN9926-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN9926-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
159991-67-0
Target
Antibiotic, Antifungal
Related Pathways
Microbiology/Virology
Bioactivity
Phoslactomycin A exhibits weaker activity against Gram-positive bacteria, yet it shows stronger efficacy against fungi.
Smiles
[C@]([C@@H](C[C@H](/C=C\C=C/[C@H]1C[C@@H](OC(C(C)C)=O)CCC1)O)OP(=O)(O)O)(/C=C/[C@H]2[C@@H](CC)C=CC(=O)O2)(CCN)O
Molecular Formula
C29H46NO10P
Molecular Weight
599.65
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Phoslactomycin A

Phoslactomycin A has been reported in Streptomyces platensis with data available.

CAS Number159991-67-0
PubChem CID6443962
IUPAC Name[3-[(1E,3E,9E)-8-(2-aminoethyl)-10-(3-ethyl-6-oxo-2,3-dihydropyran-2-yl)-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 2-methylpropanoate
Molecular FormulaC29H46NO10P
Molecular Weight599.6
XLogP-0.4
Topological Polar Surface Area186
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count16
Heavy Atom Count41
Formal Charge0
Complexity1020
SMILES
CCC1C=CC(=O)OC1/C=C/C(CCN)(C(CC(/C=C/C=C/C2CCCC(C2)OC(=O)C(C)C)O)OP(=O)(O)O)O
InChI
InChI=1S/C29H46NO10P/c1-4-22-12-13-27(32)39-25(22)14-15-29(34,16-17-30)26(40-41(35,36)37)19-23(31)10-6-5-8-21-9-7-11-24(18-21)38-28(33)20(2)3/h5-6,8,10,12-15,20-26,31,34H,4,7,9,11,16-19,30H2,1-3H3,(H2,35,36,37)/b8-5+,10-6+,15-14+
InChIKey
LOAKADZNOAGFPM-XNHNZVDCSA-N
Chemical Structure
2D Structure
2D structure of Phoslactomycin A
CAS: 159991-67-0
CID: 6443962
Formula: C29H46NO10P
MW: 599.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight599.6
XLogP3-0.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count16
Exact Mass599.28593366
Monoisotopic Mass599.28593366
Topological Polar Surface Area186 Ų
Heavy Atom Count41
Formal Charge0
Complexity1020
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count7
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes