Products for Research Use Only
RegisterLogin

(±) -Strigol

CAT: 0127-BICR133-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BICR133-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
51820-11-2
Synonyms
(3aR*,5S*,8bS*,2'R*) -3-[ (E) -2',5'-dihydro-4'-methyl-5'-oxo-2'-furanyloxymethylene]-5-hydroxy-8,8-dimethyl-3,3a,4,5,6,7,8,8b-octahydroindeno[1,2-b]furan-2-one
MDL Number
MFCD27665492
Smiles
CC1=C[C@H](O\C=C\2/[C@H]3CC4=C([C@H]3OC2=O)C(C)(C)CC[C@@H]4O)OC1=O
Additionnal Information
Store at -20°C
Storage Conditions
Store at -20°C

Chemical Information

(+/-)-Strigol

See also: Strigol (annotation moved to).

CAS Number51820-11-2
PubChem CID442090
IUPAC Name(3aR,5S,8bS)-5-hydroxy-8,8-dimethyl-3-[[(2R)-4-methyl-5-oxo-2H-furan-2-yl]oxymethylidene]-3a,4,5,6,7,8b-hexahydroindeno[1,2-b]furan-2-one
Molecular FormulaC19H22O6
Molecular Weight346.4
XLogP1.3
Topological Polar Surface Area82.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity741
SMILES
CC1=C[C@@H](OC1=O)OC=C2[C@H]3CC4=C([C@H]3OC2=O)C(CC[C@@H]4O)(C)C
InChI
InChI=1S/C19H22O6/c1-9-6-14(24-17(9)21)23-8-12-10-7-11-13(20)4-5-19(2,3)15(11)16(10)25-18(12)22/h6,8,10,13-14,16,20H,4-5,7H2,1-3H3/t10-,13+,14-,16+/m1/s1
InChIKey
VOFXXOPWCBSPAA-FTOGJNOLSA-N
Chemical Structure
2D Structure
2D structure of (+/-)-Strigol
CAS: 51820-11-2
CID: 442090
Formula: C19H22O6
MW: 346.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight346.4
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass346.14163842
Monoisotopic Mass346.14163842
Topological Polar Surface Area82.1 Ų
Heavy Atom Count25
Formal Charge0
Complexity741
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
AR-S01923-01(+) -Strigol
AR-S01924-01(+) -Strigol Acetate
436334(±) 5-Deoxy-strigol
TRC-D231710-100MG(±)5-Deoxy-strigol
AR-S09594-01(+/-) 5-Deoxy-strigol
TRC-D231715-25MG(-)-5-Deoxy-strigol
AR-S01925-01(+) -Strigol Acetate-d3
TRC-E582290-25MG(+)2´-epi-5-Deoxy-strigol
TRC-E582295-25MG(-)2´-epi-5-Deoxy-strigol
TRC-E582285-100MG(±)2´-Epi-5-deoxy-strigol

Popular Products