Products for Research Use Only
RegisterLogin

A 83016A

CAT: 0013-GTR19198397-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19198397-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
This product, 83016A, is a member of the kinamycin class of antibiotics. It serves as a valuable research tool for studying the biological activity and mechanisms of action of these compounds in both in vitro and in vivo experimental models.
CAS Number
142383-42-4
Field of Research
Infectious Disease & Virology
Smiles
CC (C) C (=O) OC1C (OC (C) =O) c2c (C (OC (=O) C (C) C) C1 (C) O) n (C#N) c1c2C (=O) c2cccc (O) c2C1=O
Molecular Formula
C28H28N2O10
Molecular Weight
552.536
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

A 83016A

a kinamycin-type antibiotic; from an unidentified actinomycete designated A83016; structure given in first source

CAS Number142383-42-4
PubChem CID132424
IUPAC Name[(1S,2R,3S,4R)-1-acetyloxy-5-cyano-3,7-dihydroxy-3-methyl-4-(2-methylpropanoyloxy)-6,11-dioxo-2,4-dihydro-1H-benzo[b]carbazol-2-yl] 2-methylpropanoate
Molecular FormulaC28H28N2O10
Molecular Weight552.5
XLogP3.2
Topological Polar Surface Area182
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count8
Heavy Atom Count40
Formal Charge0
Complexity1140
SMILES
CC(C)C(=O)O[C@@H]1[C@H](C2=C([C@H]([C@]1(C)O)OC(=O)C(C)C)N(C3=C2C(=O)C4=C(C3=O)C(=CC=C4)O)C#N)OC(=O)C
InChI
InChI=1S/C28H28N2O10/c1-11(2)26(35)39-24-20-18(23(38-13(5)31)25(28(24,6)37)40-27(36)12(3)4)17-19(30(20)10-29)22(34)16-14(21(17)33)8-7-9-15(16)32/h7-9,11-12,23-25,32,37H,1-6H3/t23-,24+,25+,28-/m0/s1
InChIKey
UOYACWUCXHEGPZ-FQJHJXCSSA-N
Chemical Structure
2D Structure
2D structure of A 83016A
CAS: 142383-42-4
CID: 132424
Formula: C28H28N2O10
MW: 552.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight552.5
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count8
Exact Mass552.17439509
Monoisotopic Mass552.17439509
Topological Polar Surface Area182 Ų
Heavy Atom Count40
Formal Charge0
Complexity1140
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

Related Products

CatalogName
GTR19198396A 83016F
GTR19208116-01BMS-830216

Alternative Products

CatalogName
T26454-01A 83016A

Popular Products