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Ganolucidic acid E

CAT: 1410-M32505-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M32505-02Size:5 mg
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Description
Ganolucidic acid E inhibits the growth of three types of human cancer cells: Caco-2, HepG2 and HeLa cells.
CAS Number
114567-50-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
484.7
Molecular Formula
C30H44O5
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Ganolucidic Acid E

Ganolucidic acid E is a triterpenoid.

CAS Number114567-50-9
PubChem CID15602283
IUPAC Name(E,6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
Molecular FormulaC30H44O5
Molecular Weight484.7
XLogP5
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity1020
SMILES
C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1C[C@@H]([C@@]2([C@@]1(CC(=O)C3=C2CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O
InChI
InChI=1S/C30H44O5/c1-17(9-8-10-18(2)26(34)35)20-15-24(33)30(7)19-11-12-22-27(3,4)23(32)13-14-28(22,5)25(19)21(31)16-29(20,30)6/h10,17,20,22,24,33H,8-9,11-16H2,1-7H3,(H,34,35)/b18-10+/t17-,20-,22+,24+,28+,29-,30-/m1/s1
InChIKey
XRBLVCACUHPHDE-NKRIBODASA-N
Chemical Structure
2D Structure
2D structure of Ganolucidic Acid E
CAS: 114567-50-9
CID: 15602283
Formula: C30H44O5
MW: 484.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight484.7
XLogP35
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass484.31887450
Monoisotopic Mass484.31887450
Topological Polar Surface Area91.7 Ų
Heavy Atom Count35
Formal Charge0
Complexity1020
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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