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(±) 9,10-DiHODE

CAT: 0931-TN11210-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN11210-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1400693-71-1
Target
Others
Related Pathways
Others
Bioactivity
(±) 9,10-DiHODE (compound 4) is a plant-derived oxylipin formed by reducing the carbonyl group of an α-ketol to produce adjacent diols. In plants, it serves as a crucial signaling molecule, influencing growth and flowering processes through regulation.
Smiles
[C@H]([C@@H](C/C=C\C/C=C\CC)O)(CCCCCCCC(O)=O)O
Molecular Formula
C18H32O4
Molecular Weight
312.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(inverted exclamation markA)9,10-DiHODE
CAS Number1400693-71-1
PubChem CID101434044
IUPAC Name(9R,10R,12Z,15Z)-9,10-dihydroxyoctadeca-12,15-dienoic acid
Molecular FormulaC18H32O4
Molecular Weight312.4
XLogP3.9
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Heavy Atom Count22
Formal Charge0
Complexity323
SMILES
CC/C=C\C/C=C\C[C@H]([C@@H](CCCCCCCC(=O)O)O)O
InChI
InChI=1S/C18H32O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h3-4,7,10,16-17,19-20H,2,5-6,8-9,11-15H2,1H3,(H,21,22)/b4-3-,10-7-/t16-,17-/m1/s1
InChIKey
QRHSEDZBZMZPOA-VLHUJMHNSA-N
Chemical Structure
2D Structure
2D structure of (inverted exclamation markA)9,10-DiHODE
CAS: 1400693-71-1
CID: 101434044
Formula: C18H32O4
MW: 312.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight312.4
XLogP33.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass312.23005950
Monoisotopic Mass312.23005950
Topological Polar Surface Area77.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity323
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-176104(±) 9,10-DiHODE (γ)
HY-N12966-01(±) 9,10-DiHODE
HY-172579(±) 15,16-DiHODE
HY-176105(±) 6,7-DiHODE (γ)
GTR19279554-01(7S,8S) -DiHODE
GTR19265582-0112 (S),13 (S) -DiHODE
HY-1454778 (R),11 (S) -DiHODE
OR95345-0110,10'-Dibromo-9,9'-bianthracene
FH HB 0008-019,10-diphenylanthracene-9,10-diol
sc-48214310,10'-Dibromo-9,9'-bianthryl

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