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Glaucocalyxin B

CAT: 0013-GTR19164455-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164455-03Size:5 mg
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Description
Glaucocalyxin B
CAS Number
80508-81-2
Product Name Alternative
Autophagy, Glaucocalyxin B, Inhibitor, inhibit
Field of Research
Cell Biology
Purity
99.13% (May vary between batches)
Solubility
DMSO:Soluble
Smiles
[H][C@@]12CC[C@@H]3[C@@H] (OC (C) =O) [C@@]1 ([C@H] (O) C[C@]1 ([H]) C (C) (C) C (=O) CC[C@@]21C) C (=O) C3=C
Molecular Formula
C22H30O5
Molecular Weight
374.47
Storage Conditions
Keep away from direct sunlight, keep away from moisture, store at low temperature, store under nitrogen | Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

(7alpha,14R)-14-(Acetyloxy)-7-hydroxykaur-16-ene-3,15-dione

Glaucocalyxin B has been reported in Isodon japonicus and Isodon pharicus with data available.

CAS Number80508-81-2
PubChem CID14193399
IUPAC Name[(1R,2R,4S,9R,10S,13S,16R)-2-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxo-16-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate
Molecular FormulaC22H30O5
Molecular Weight374.5
XLogP2.3
Topological Polar Surface Area80.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count27
Formal Charge0
Complexity752
SMILES
CC(=O)O[C@@H]1[C@H]2CC[C@@H]3[C@]1([C@@H](C[C@H]4[C@]3(CCC(=O)C4(C)C)C)O)C(=O)C2=C
InChI
InChI=1S/C22H30O5/c1-11-13-6-7-14-21(5)9-8-16(24)20(3,4)15(21)10-17(25)22(14,18(11)26)19(13)27-12(2)23/h13-15,17,19,25H,1,6-10H2,2-5H3/t13-,14-,15+,17+,19+,21-,22-/m0/s1
InChIKey
LSUXOKVMORWDLT-KEXKRWMXSA-N
Chemical Structure
2D Structure
2D structure of (7alpha,14R)-14-(Acetyloxy)-7-hydroxykaur-16-ene-3,15-dione
CAS: 80508-81-2
CID: 14193399
Formula: C22H30O5
MW: 374.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight374.5
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass374.20932405
Monoisotopic Mass374.20932405
Topological Polar Surface Area80.7 Ų
Heavy Atom Count27
Formal Charge0
Complexity752
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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