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Polyporusterone B

CAT: 0013-GTR19165041-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165041-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Polyporusterone B is a pentahydroxy triterpenoid isolated from Polyporus umbellatus. It demonstrates antioxidant activity by inhibiting free radical-induced erythrocyte hemolysis in vitro, making it a compound of interest for research in oxidative stress and cell membrane stability.
CAS Number
141360-89-6
Product Name Alternative
Carboxylic, anti-oxidative, (1R,2R,4S,5R,7R,11R,14S,15R) -14-[ (2R,3R) -2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-4,5,11-trihydroxy-2,15-dimethyltetracyclo[8.7.0.02, ?.011,1?]heptadec-9-en-8-one, acid, activity, inhibit, Inhibitor, hemolysis, scavenging, radical, Polyporusterone B, triterpene
Purity
98.65% (May vary between batches)
Solubility
DMSO:50 mg/mL (104.9 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.2 mM)
Smiles
[H][C@]12CC[C@]3 (C) [C@H] (CC[C@@]3 (O) C1=CC (=O) [C@]1 ([H]) C[C@@H] (O) [C@@H] (O) C[C@]21C) [C@@] (C) (O) [C@H] (O) CC (=C) C (C) C
Molecular Formula
C28H44O6
Molecular Weight
476.65
Storage Conditions
Keep away from direct sunlight, keep away from moisture | 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

(2S,3R,5R,9R,10R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one

Polyporusterone B is a steroid.

CAS Number141360-89-6
PubChem CID15168041
IUPAC Name(2S,3R,5R,9R,10R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Molecular FormulaC28H44O6
Molecular Weight476.6
XLogP2.3
Topological Polar Surface Area118
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity895
SMILES
CC(C)C(=C)C[C@H]([C@@](C)([C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)O)O
InChI
InChI=1S/C28H44O6/c1-15(2)16(3)11-24(32)27(6,33)23-8-10-28(34)18-12-20(29)19-13-21(30)22(31)14-25(19,4)17(18)7-9-26(23,28)5/h12,15,17,19,21-24,30-34H,3,7-11,13-14H2,1-2,4-6H3/t17-,19-,21+,22-,23-,24+,25+,26+,27+,28+/m0/s1
InChIKey
OQDKHYZVFZGSRC-DWJOQFFMSA-N
Chemical Structure
2D Structure
2D structure of (2S,3R,5R,9R,10R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
CAS: 141360-89-6
CID: 15168041
Formula: C28H44O6
MW: 476.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.6
XLogP32.3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass476.31378912
Monoisotopic Mass476.31378912
Topological Polar Surface Area118 Ų
Heavy Atom Count34
Formal Charge0
Complexity895
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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