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Fujianmycin B

CAT: 0804-HY-108993Size: 1 EachDry Ice: NoHazardous: No
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Description
Fujianmycin B (SNA-8073A) is found in the strain of Streptomyces sp[1].
CAS Number
130548-09-3
Product Name Alternative
SNA-8073A; Rubiginone A2
UNSPSC
12352005
Target
Others
Related Pathways
Others
Field of Research
Others
Smiles
O=C1C[C@@H](C)[C@H](O)C(C1=C2C3=O)=CC=C2C(C4=C3C=CC=C4OC)=O
Molecular Formula
C20H16O5
Molecular Weight
336.34
References & Citations
[1]K Kimura, et al. SNA-8073-B, a new isotetracenone antibiotic inhibits prolyl endopeptidase. I. Fermentation, isolation and biological properties. J Antibiot (Tokyo) . 1997 Apr;50 (4) :291-6.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Fujianmycin B

Fujianmycin B is an angucycline.

CAS Number130548-09-3
PubChem CID11232973
IUPAC Name(3R,4S)-4-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
Molecular FormulaC20H16O5
Molecular Weight336.3
XLogP2.3
Topological Polar Surface Area80.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count25
Formal Charge0
Complexity599
SMILES
C[C@@H]1CC(=O)C2=C([C@H]1O)C=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)OC
InChI
InChI=1S/C20H16O5/c1-9-8-13(21)15-11(18(9)22)6-7-12-17(15)20(24)10-4-3-5-14(25-2)16(10)19(12)23/h3-7,9,18,22H,8H2,1-2H3/t9-,18+/m1/s1
InChIKey
MUNUJAJWLPOQBH-LZVRBXCZSA-N
Chemical Structure
2D Structure
2D structure of Fujianmycin B
CAS: 130548-09-3
CID: 11232973
Formula: C20H16O5
MW: 336.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight336.3
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass336.09977361
Monoisotopic Mass336.09977361
Topological Polar Surface Area80.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity599
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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