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Lathyrol

CAT: 0013-GTR19170109-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170109-01Size:5 mg
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Description
This small molecule lathyrol diterpene modulates P-glycoprotein (P-gp/ABCB1) activity, functioning as a multidrug resistance (MDR) reversal agent. It is a valuable research tool for studying drug efflux mechanisms and chemosensitization in both in vitro cell-based assays and in vivo cancer research models.
CAS Number
34420-19-4
Product Name Alternative
Lathyrol, Inhibitor, inhibit
Purity
99.37% (May vary between batches)
Solubility
DMSO:55 mg/mL (164.45 mM)
Smiles
C[C@H]1C[C@@]2 (O) [C@H] ([C@H]1O) [C@@H] (O) C (=C) CC[C@H]1[C@@H] (\C=C (C) /C2=O) C1 (C) C
Molecular Formula
C20H30O4
Molecular Weight
334.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Npc226958

See also: Lathyrol (annotation moved to).

CAS Number34420-19-4
PubChem CID6443057
IUPAC Name(1R,3Z,5R,7S,11R,12R,13S,14S)-1,11,13-trihydroxy-3,6,6,14-tetramethyl-10-methylidenetricyclo[10.3.0.05,7]pentadec-3-en-2-one
Molecular FormulaC20H30O4
Molecular Weight334.4
XLogP2.2
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count24
Formal Charge0
Complexity605
SMILES
C[C@H]1C[C@]2([C@H]([C@H]1O)[C@H](C(=C)CC[C@H]3[C@H](C3(C)C)/C=C(\C2=O)/C)O)O
InChI
InChI=1S/C20H30O4/c1-10-6-7-13-14(19(13,4)5)8-11(2)18(23)20(24)9-12(3)17(22)15(20)16(10)21/h8,12-17,21-22,24H,1,6-7,9H2,2-5H3/b11-8-/t12-,13-,14+,15-,16-,17-,20+/m0/s1
InChIKey
SDBITTRHSROXCY-ZVOALYMASA-N
Chemical Structure
2D Structure
2D structure of Npc226958
CAS: 34420-19-4
CID: 6443057
Formula: C20H30O4
MW: 334.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight334.4
XLogP32.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass334.21440943
Monoisotopic Mass334.21440943
Topological Polar Surface Area77.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity605
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

Alternative Products

CatalogName
MBS387004-01Lathyrol
A12082-25Lathyrol 25mg
A12082-2Lathyrol 2mg
HY-N0561RLathyrol (Standard)
A12082-100Lathyrol 100mg
A12082-5Lathyrol 5mg
A12082-50Lathyrol 50mg
A12082-10Lathyrol 10mg
A12082-10mM-DLathyrol 10mM * 1mL in DMSO
164737Lathyrol-3,15-diacetate-5-benzoate

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