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FR-900482

CAT: 0931-TN10818-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10818-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
108814-63-7
Target
Antibacterial, Antibiotic
Related Pathways
Microbiology/Virology
Bioactivity
FR-900482 exhibits high sensitivity to Thermoactinomyces calidolactis strain C 953 and demonstrates activity against cell lines such as P388, B16, EL4, FM3A, L1210, BHK-21, among others.
Smiles
O[C@]12[C@@]3([C@@](N3)(C[N@](O1)C=4C([C@@H]2COC(N)=O)=C(O)C=C(C=O)C4)[H])[H]
Molecular Formula
C14H15N3O6
Molecular Weight
321.29
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

[(8R,9S,10S,12S)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-8-yl]methyl carbamate

[(8R,9S,10S,12S)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-8-yl]methyl carbamate has been reported in Streptomyces with data available.

CAS Number108814-63-7
PubChem CID10947192
IUPAC Name[(8R,9S,10S,12S)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-8-yl]methyl carbamate
Molecular FormulaC14H15N3O6
Molecular Weight321.28
XLogP-1.1
Topological Polar Surface Area144
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity533
SMILES
C1[C@H]2[C@H](N2)[C@@]3([C@H](C4=C(N1O3)C=C(C=C4O)C=O)COC(=O)N)O
InChI
InChI=1S/C14H15N3O6/c15-13(20)22-5-7-11-9(1-6(4-18)2-10(11)19)17-3-8-12(16-8)14(7,21)23-17/h1-2,4,7-8,12,16,19,21H,3,5H2,(H2,15,20)/t7-,8-,12-,14-/m0/s1
InChIKey
XVPSPMLUMQEEIU-QGVZQFPHSA-N
Chemical Structure
2D Structure
2D structure of [(8R,9S,10S,12S)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-8-yl]methyl carbamate
CAS: 108814-63-7
CID: 10947192
Formula: C14H15N3O6
MW: 321.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight321.28
XLogP3-1.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass321.09608521
Monoisotopic Mass321.09608521
Topological Polar Surface Area144 Ų
Heavy Atom Count23
Formal Charge0
Complexity533
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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