Minnelide

CAT: 0931-T12042-04Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0931-T12042-04Size:2 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1254702-87-8

Target

Apoptosis, Virus Protease

Related Pathways

Apoptosis, Microbiology/Virology

Purity

0.9959

Bioactivity

Minnelide is a water-soluble tretinoin lactone prodrug with anticancer and antitumor activity that induces apoptosis and may prevent podocyte damage.Minnelide inhibits cervical cancer growth by blocking HPV-induced changes in p53 and pRb.

Smiles

C[C@@]12[C@@]34[C@@]5([C@@](C[C@@]1([H])C6=C(C(OC6)=O)CC2)([H])O5)[C@@H]([C@@]7([C@](O7)([H])[C@]3([H])O4)C(C)C)OCOP([O-])([O-])=O.[Na+].[Na+]

Molecular Formula

C21H25Na2O10P

Molecular Weight

514.37

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Minnelide

Triptolide Analog is a water soluble analog of the diterpenoid triepoxide triptolide isolated from the Chinese herb Tripterygium wilfordii Hook.f., with potential antineoplastic activity. Upon intravenous administration, the triptolide analog inhibits heat shock protein 70 (HSP70) and prevents HSP70-mediated inhibition of apoptosis. This leads to both the induction of apoptosis and a reduction of cancer cell growth. HSP70, a molecular chaperone upregulated in various cancer cells, plays a key role in the inhibition of caspase-dependent and -independent apoptosis.

CAS Number	1254702-87-8
PubChem CID	46203139
IUPAC Name	disodium;[(1S,2S,4S,5S,7S,8R,9R,11S,13S)-1-methyl-17-oxo-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-8-yl]oxymethyl phosphate
Molecular Formula	C21H25Na2O10P
Molecular Weight	514.4
Topological Polar Surface Area	146
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	4
Heavy Atom Count	34
Formal Charge	0
Complexity	1010

SMILES

CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(CCC6=C([C@@H]5C[C@H]7[C@]4([C@@H]2OCOP(=O)([O-])[O-])O7)COC6=O)C.[Na+].[Na+]

InChI

InChI=1S/C21H27O10P.2Na/c1-9(2)19-14(30-19)15-21(31-15)18(3)5-4-10-11(7-26-16(10)22)12(18)6-13-20(21,29-13)17(19)27-8-28-32(23,24)25;;/h9,12-15,17H,4-8H2,1-3H3,(H2,23,24,25);;/q;2*+1/p-2/t12-,13-,14-,15-,17+,18-,19-,20+,21+;;/m0../s1

InChIKey

ZHBJMVNZRZUQEP-KIKMAQITSA-L

Chemical Structure

2D Structure

CAS: 1254702-87-8

CID: 46203139

Formula: C21H25Na2O10P

MW: 514.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	514.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	4
Exact Mass	514.09807255
Monoisotopic Mass	514.09807255
Topological Polar Surface Area	146 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	1010
Isotope Atom Count	0
Defined Atom Stereocenter Count	9
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BA2781-25	Minnelide
A18955-10	Minnelide 10mg
A18955-25	Minnelide 25mg
A18955-50	Minnelide 50mg
A18955-1	Minnelide 1mg
GTR19208271-01	Minnelide free acid
A18955-100	Minnelide 100mg
A18955-5	Minnelide 5mg
A18955-2	Minnelide 2mg
HY-124584A	Minnelide (free base)

Minnelide

Chemical Information

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