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Ganoderic acid D2

CAT: 1410-M31766-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Ganoderic acid D2 is a natural product.
CAS Number
97653-94-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
530.65
Molecular Formula
C30H42O8
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Ganoderic acid D2
CAS Number97653-94-6
PubChem CID20055987
IUPAC Name(6R)-6-[(5R,7S,10S,12S,13R,14R,17R)-7,12-dihydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
Molecular FormulaC30H42O8
Molecular Weight530.6
XLogP1.3
Topological Polar Surface Area146
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count38
Formal Charge0
Complexity1150
SMILES
C[C@H](CC(=O)CC(C)C(=O)O)[C@H]1CC(=O)[C@@]2([C@@]1([C@@H](C(=O)C3=C2[C@H](C[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)O)O)C)C
InChI
InChI=1S/C30H42O8/c1-14(10-16(31)11-15(2)26(37)38)17-12-21(34)30(7)22-18(32)13-19-27(3,4)20(33)8-9-28(19,5)23(22)24(35)25(36)29(17,30)6/h14-15,17-19,25,32,36H,8-13H2,1-7H3,(H,37,38)/t14-,15?,17-,18+,19+,25-,28+,29+,30+/m1/s1
InChIKey
LCIUOVOXWPIXOR-OHISEBISSA-N
Chemical Structure
2D Structure
2D structure of Ganoderic acid D2
CAS: 97653-94-6
CID: 20055987
Formula: C30H42O8
MW: 530.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight530.6
XLogP31.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass530.28796829
Monoisotopic Mass530.28796829
Topological Polar Surface Area146 Ų
Heavy Atom Count38
Formal Charge0
Complexity1150
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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