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Ganoderic acid GS-1

CAT: 1410-M32529-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M32529-02Size:5 mg
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Description
Ganoderic acid GS-1, a highly oxygenated lanostane-type triterpenoid, has anti-HIV-1 protease activities with an IC 50 of 58 μM.
CAS Number
1206781-64-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
498.7
Molecular Formula
C30H42O6
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Ganoderic acid GS-1

Ganoderic acid GS-1 is a triterpenoid.

CAS Number1206781-64-7
PubChem CID44473462
IUPAC Name(E,6R)-6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Molecular FormulaC30H42O6
Molecular Weight498.6
XLogP3.4
Topological Polar Surface Area109
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count36
Formal Charge0
Complexity1090
SMILES
C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC(=O)[C@@]2([C@@]1(CC(=O)C3=C2[C@H](C[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)O)C)C
InChI
InChI=1S/C30H42O6/c1-16(9-8-10-17(2)26(35)36)18-13-23(34)30(7)25-19(31)14-21-27(3,4)22(33)11-12-28(21,5)24(25)20(32)15-29(18,30)6/h10,16,18-19,21,31H,8-9,11-15H2,1-7H3,(H,35,36)/b17-10+/t16-,18-,19+,21+,28+,29-,30+/m1/s1
InChIKey
AMQGNLQZSMPDGV-DUUWRNHESA-N
Chemical Structure
2D Structure
2D structure of Ganoderic acid GS-1
CAS: 1206781-64-7
CID: 44473462
Formula: C30H42O6
MW: 498.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight498.6
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass498.29813906
Monoisotopic Mass498.29813906
Topological Polar Surface Area109 Ų
Heavy Atom Count36
Formal Charge0
Complexity1090
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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