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Ganoderic acid DM

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Description
Ganoderic acid DM is an antiandrogenic osteoclastogenesis inhibitor, it especially suppresses the expression of c-Fos and nuclear factor of activated T cells c1 (NFATc1) .
CAS Number
173075-45-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
468.7
Molecular Formula
C30H44O4
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Ganoderic Acid Dm

Ganoderic acid DM is a triterpenoid.

CAS Number173075-45-1
PubChem CID11784642
IUPAC Name(E,6R)-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7-dioxo-2,5,6,11,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]hept-2-enoic acid
Molecular FormulaC30H44O4
Molecular Weight468.7
XLogP6.4
Topological Polar Surface Area71.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity984
SMILES
C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC[C@@]2([C@@]1(CCC3=C2C(=O)C[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C
InChI
InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-11-16-30(7)25-21(12-15-29(20,30)6)28(5)14-13-24(32)27(3,4)23(28)17-22(25)31/h10,18,20,23H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10+/t18-,20-,23+,28-,29-,30+/m1/s1
InChIKey
ZTKZZRIVAYGFSF-PIPDTRPPSA-N
Chemical Structure
2D Structure
2D structure of Ganoderic Acid Dm
CAS: 173075-45-1
CID: 11784642
Formula: C30H44O4
MW: 468.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight468.7
XLogP36.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass468.32395988
Monoisotopic Mass468.32395988
Topological Polar Surface Area71.4 Ų
Heavy Atom Count34
Formal Charge0
Complexity984
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes