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3,2'-Epilarixinol

CAT: 0931-TN2855Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN2855Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1207671-28-0
Target
Others
Related Pathways
Others
Bioactivity
3,2'-Epilarixinol is a natural product for research related to life sciences. The catalog number is TN2855 and the CAS number is 1207671-28-0.
Smiles
O[C@H]1Cc2c(O)cc3OC(=O)[C@@]4([C@@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1
Molecular Formula
C30H22O10
Molecular Weight
542.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,2'-Epilarixinol
CAS Number1207671-28-0
PubChem CID102594520
IUPAC Name(2S,2'R,3R,3'S)-3',4,5',6-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)spiro[2H-1-benzofuran-3,9'-3,4-dihydro-2H-furo[2,3-h]chromene]-8'-one
Molecular FormulaC30H22O10
Molecular Weight542.5
XLogP3.3
Topological Polar Surface Area166
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count2
Heavy Atom Count40
Formal Charge0
Complexity947
SMILES
C1[C@@H]([C@H](OC2=C1C(=CC3=C2[C@]4([C@@H](OC5=CC(=CC(=C54)O)O)C6=CC=C(C=C6)O)C(=O)O3)O)C7=CC=C(C=C7)O)O
InChI
InChI=1S/C30H22O10/c31-15-5-1-13(2-6-15)26-21(36)11-18-19(34)12-23-25(27(18)40-26)30(29(37)39-23)24-20(35)9-17(33)10-22(24)38-28(30)14-3-7-16(32)8-4-14/h1-10,12,21,26,28,31-36H,11H2/t21-,26+,28-,30+/m0/s1
InChIKey
RNDNBGULZNCSNB-PXRMNYBDSA-N
Chemical Structure
2D Structure
2D structure of 3,2'-Epilarixinol
CAS: 1207671-28-0
CID: 102594520
Formula: C30H22O10
MW: 542.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight542.5
XLogP33.3
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count2
Exact Mass542.12129689
Monoisotopic Mass542.12129689
Topological Polar Surface Area166 Ų
Heavy Atom Count40
Formal Charge0
Complexity947
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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Alternative Products

CatalogName
MBS57614323,2'-Epilarixinol
PC4503102,2,3,3,3-Pentafluoropropyl 2,2,3,3-tetrafluoropropyl carbonate
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PC49692,2,3,3,3-Pentafluoropropyl-2'-fluoroacrylate
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PC31768-012,3,3,3-Tetrafluoro-2- (1,1,2,2,3,3,3-heptafluoropropoxy) propanamide
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