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Ossamycin

CAT: 0931-TN10098-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10098-02Size:50 mg
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CAS Number
2057463-74-6
Target
Antibacterial, Antibiotic, Antifungal
Related Pathways
Microbiology/Virology
Bioactivity
Ossamycin is a macrolide antibiotic with notable antifungal properties and a relatively weak effect against Gram-positive bacteria. In cell culture studies, it inhibits L cells, Epstein-Barr ascites carcinoma cells, KB cells, Sarcoma-180 cells, L-1210 cells, and HeLa cells, with IC50 values of 0.007, 0.008, 0.005, 0.008, 0.003, and 0.005 μg/mL, respectively.
Smiles
C([C@@H](CC)O)[C@@H]1O[C@@]2(O[C@]3(C[C@@]4(O)[C@@](CC(C)(C)O4)(/C=C/CCCCC[C@@](C)(O)[C@H](O)[C@@H](O[C@@H]5O[C@@H](C)[C@@H](N(C)C)CC5)[C@H](O)[C@@H](C)[C@H](O)[C@](C)(O)\C=C\C(=O)O[C@@](C2)([C@@H]3C)[H])[H])[H])CCC1
Molecular Formula
C49H85NO14
Molecular Weight
912.198
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ossamycin

Ossamycin is a macrolide antibiotic that was originally isolated from the culture broths of Streptomyces hygroscopicus var. ossamyceticus. It has a role as an antineoplastic agent and a bacterial metabolite. It is a macrolide antibiotic, a tertiary alcohol, a secondary alcohol, an organic heterotetracyclic compound, a cyclic hemiketal and a spiroketal.

CAS Number2057463-74-6
PubChem CID10748327
IUPAC Name(1S,3S,6'R,7S,8E,15R,16R,17S,18R,19R,20S,21R,22E,26S,28R,30R)-17-[(2S,5S,6S)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-3,15,16,18,20,21-hexahydroxy-6'-[(2R)-2-hydroxybutyl]-5,5,15,19,21,30-hexamethylspiro[4,25,29-trioxatricyclo[24.3.1.03,7]triaconta-8,22-diene-28,2'-oxane]-24-one
Molecular FormulaC49H85NO14
Molecular Weight912.2
XLogP4.7
Topological Polar Surface Area217
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count6
Heavy Atom Count64
Formal Charge0
Complexity1560
SMILES
CC[C@H](C[C@H]1CCC[C@]2(O1)C[C@H]3[C@@H]([C@@H](O2)C[C@]4([C@@H](CC(O4)(C)C)/C=C/CCCCC[C@@]([C@@H]([C@H]([C@@H]([C@H]([C@@H]([C@](/C=C/C(=O)O3)(C)O)O)C)O)O[C@H]5CC[C@@H]([C@@H](O5)C)N(C)C)O)(C)O)O)C)O
InChI
InChI=1S/C49H85NO14/c1-11-34(51)26-35-19-17-24-48(62-35)28-37-30(2)38(63-48)29-49(58)33(27-45(5,6)64-49)18-15-13-12-14-16-23-46(7,56)44(55)42(61-40-21-20-36(50(9)10)32(4)59-40)41(53)31(3)43(54)47(8,57)25-22-39(52)60-37/h15,18,22,25,30-38,40-44,51,53-58H,11-14,16-17,19-21,23-24,26-29H2,1-10H3/b18-15+,25-22+/t30-,31+,32-,33+,34+,35+,36-,37-,38-,40-,41+,42-,43-,44+,46+,47+,48+,49-/m0/s1
InChIKey
XGECDDPXIKFBTE-AUFVQPSPSA-N
Chemical Structure
2D Structure
2D structure of Ossamycin
CAS: 2057463-74-6
CID: 10748327
Formula: C49H85NO14
MW: 912.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight912.2
XLogP34.7
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count6
Exact Mass911.59700639
Monoisotopic Mass911.59700639
Topological Polar Surface Area217 Ų
Heavy Atom Count64
Formal Charge0
Complexity1560
Isotope Atom Count0
Defined Atom Stereocenter Count18
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Ossamycin | 0931-TN10098-02 | Gentaur