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Leachianol F

CAT: 0931-TN6476Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN6476Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
164123-50-6
Bioactivity
Leachianol F is a natural product for research related to life sciences. The catalog number is TN6476 and the CAS number is 164123-50-6.
Smiles
[H][C@@]1([C@H](O)c2ccc(O)cc2)[C@H]([C@@H](c2c1cc(O)cc2O)c1ccc(O)cc1)c1cc(O)cc(O)c1
Molecular Formula
C28H24O7
Molecular Weight
472.493
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Leachianol F
CAS Number164123-50-6
PubChem CID145874189
IUPAC Name(1R,2S,3R)-3-(3,5-dihydroxyphenyl)-1-[(S)-hydroxy-(4-hydroxyphenyl)methyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol
Molecular FormulaC28H24O7
Molecular Weight472.5
XLogP3.9
Topological Polar Surface Area142
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count35
Formal Charge0
Complexity679
SMILES
C1=CC(=CC=C1[C@H]2[C@@H](C3=C([C@@H]2[C@@H](C4=CC=C(C=C4)O)O)C=C(C=C3O)O)C5=CC(=CC(=C5)O)O)O
InChI
InChI=1S/C28H24O7/c29-17-5-1-14(2-6-17)24-25(16-9-19(31)11-20(32)10-16)26-22(12-21(33)13-23(26)34)27(24)28(35)15-3-7-18(30)8-4-15/h1-13,24-25,27-35H/t24-,25-,27-,28+/m0/s1
InChIKey
FIWQALXNBGJRQL-DNZWLJDLSA-N
Chemical Structure
2D Structure
2D structure of Leachianol F
CAS: 164123-50-6
CID: 145874189
Formula: C28H24O7
MW: 472.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight472.5
XLogP33.9
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass472.15220310
Monoisotopic Mass472.15220310
Topological Polar Surface Area142 Ų
Heavy Atom Count35
Formal Charge0
Complexity679
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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