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Longilactone

CAT: 0931-T126080-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T126080-01Size:1 mg
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CAS Number
129587-09-3
Target
Others
Related Pathways
Others
Bioactivity
Longilactone is a useful organic compound for research related to life sciences. The catalog number is T126080 and the CAS number is 129587-09-3.
Smiles
C[C@@H]1C2C(=O)O[C@@H]3[C@H](O)C4C(C)=CC(=O)[C@@H](O)[C@]4(C)C([C@H](O)[C@@H]1O)[C@]23C
Molecular Formula
C19H26O7
Molecular Weight
366.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Longilactone

Longilactone has been reported in Eurycoma longifolia with data available.

CAS Number129587-09-3
PubChem CID45783039
IUPAC Name(2S,3S,8R,9S,13R,14R,15S,16R)-3,8,14,15-tetrahydroxy-2,6,13,16-tetramethyl-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-5-ene-4,11-dione
Molecular FormulaC19H26O7
Molecular Weight366.4
XLogP-0.6
Topological Polar Surface Area124
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count0
Heavy Atom Count26
Formal Charge0
Complexity717
SMILES
C[C@H]1[C@H]([C@H](C2[C@@]3(C1C(=O)O[C@@H]3[C@@H](C4[C@@]2([C@@H](C(=O)C=C4C)O)C)O)C)O)O
InChI
InChI=1S/C19H26O7/c1-6-5-8(20)15(24)18(3)9(6)12(22)16-19(4)10(17(25)26-16)7(2)11(21)13(23)14(18)19/h5,7,9-16,21-24H,1-4H3/t7-,9?,10?,11-,12-,13-,14?,15-,16-,18+,19+/m1/s1
InChIKey
KBBRVTNGCNCUCX-IRLOYWMGSA-N
Chemical Structure
2D Structure
2D structure of Longilactone
CAS: 129587-09-3
CID: 45783039
Formula: C19H26O7
MW: 366.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight366.4
XLogP3-0.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count0
Exact Mass366.16785316
Monoisotopic Mass366.16785316
Topological Polar Surface Area124 Ų
Heavy Atom Count26
Formal Charge0
Complexity717
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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