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7-Oxoganoderic acid Z

CAT: 0013-GTR19229574-02Size: 2 mgDry Ice: NoHazardous: No
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Description
7-Oxoganoderic acid Z (CAS 929248-72-6) is a research chemical utilized in life science studies. It is applied in both in vitro and in vivo investigations, particularly within the fields of natural product chemistry and pharmacological research.
CAS Number
929248-72-6
Field of Research
Infectious Disease & Virology
Smiles
CC (CC\C=C (/C) C (O) =O) C1CCC2 (C) C3=C (CCC12C) C1 (C) CCC (O) C (C) (C) C1CC3=O |c:15|
Molecular Formula
C30H46O4
Molecular Weight
470.694
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-Oxoganoderic acid Z
CAS Number929248-72-6
PubChem CID137955153
IUPAC Name(E)-6-(3-hydroxy-4,4,10,13,14-pentamethyl-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
Molecular FormulaC30H46O4
Molecular Weight470.7
XLogP6.7
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity941
SMILES
CC(CC/C=C(\C)/C(=O)O)C1CCC2(C1(CCC3=C2C(=O)CC4C3(CCC(C4(C)C)O)C)C)C
InChI
InChI=1S/C30H46O4/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/h10,18,20,23-24,32H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10+
InChIKey
ZNDCXCGTAALLTP-VXLYETTFSA-N
Chemical Structure
2D Structure
2D structure of 7-Oxoganoderic acid Z
CAS: 929248-72-6
CID: 137955153
Formula: C30H46O4
MW: 470.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight470.7
XLogP36.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass470.33960994
Monoisotopic Mass470.33960994
Topological Polar Surface Area74.6 Ų
Heavy Atom Count34
Formal Charge0
Complexity941
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count7
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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