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OM173-alphaA

CAT: 0498-bs-75138C-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-75138C-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
58286-56-9
Conjugation
Unconjugated
Purity
>95% (HPLC)
Buffer
Solid
Solubility
Soluble in DMSO, ethanol or methanol.
Smiles
COC(=O)C[C@H]1CC2=C([C@H](C)O1)C(=O)C1=C(O)C=CC=C1C2=O
Molecular Formula
C17H16O6
Molecular Weight
316.3
Storage Conditions
Stable for 2 years after receipt when stored at -20°C.
Appearance
Yellow solid.

Chemical Information

OM173-alphaA

OM173-alphaA has been reported in Streptomyces hebeiensis with data available.

CAS Number58286-56-9
PubChem CID12803368
IUPAC Namemethyl 2-[(1S,3R)-9-hydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetate
Molecular FormulaC17H16O6
Molecular Weight316.30
XLogP1.6
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity578
SMILES
C[C@H]1C2=C(C[C@@H](O1)CC(=O)OC)C(=O)C3=C(C2=O)C(=CC=C3)O
InChI
InChI=1S/C17H16O6/c1-8-14-11(6-9(23-8)7-13(19)22-2)16(20)10-4-3-5-12(18)15(10)17(14)21/h3-5,8-9,18H,6-7H2,1-2H3/t8-,9+/m0/s1
InChIKey
FMEUWIKCSICJBO-DTWKUNHWSA-N
Chemical Structure
2D Structure
2D structure of OM173-alphaA
CAS: 58286-56-9
CID: 12803368
Formula: C17H16O6
MW: 316.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.30
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass316.09468823
Monoisotopic Mass316.09468823
Topological Polar Surface Area89.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity578
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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