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T-Muurolol

CAT: 0931-TN7988-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN7988-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19912-62-0
Target
Others
Related Pathways
Others
Purity
0.9745
Bioactivity
T-Muurolol (epi-α-Muurolol), a sesquiterpene compound derived from Streptomyces sp. M491, possesses antimicrobial, antioxidant, and anti-inflammatory activities, and exhibits strong binding interactions with Flavin Adenine Dinucleotide (FAD) -dependent Nicotinamide Adenine Dinucleotide Phosphate (NAD (P) H) Oxidase and Cyclooxygenase-2. binding interactions.
Smiles
[C@H](C)(C)[C@H]1[C@]2([C@@]([C@@](C)(O)CC1)(CCC(C)=C2)[H])[H]
Molecular Formula
C15H26O
Molecular Weight
222.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

epi-alpha-Muurolol

(-)-Tau-muurolol is a cadinane sesquiterpenoid that consists of 4-isopropyl-1,6-dimethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalene having a hydroxy substituent at position 1 and (1S,4S,4aR,8aS)-configuration. It has a role as a fungicide, a volatile oil component, a marine metabolite, a plant metabolite and a bacterial metabolite. It is a member of octahydronaphthalenes, a cadinane sesquiterpenoid, a tertiary alcohol and a carbobicyclic compound. It is an enantiomer of a (+)-Tau-muurolol.

CAS Number19912-62-0
PubChem CID3084331
IUPAC Name(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Molecular FormulaC15H26O
Molecular Weight222.37
XLogP3.3
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity292
SMILES
CC1=C[C@H]2[C@@H](CC[C@]([C@H]2CC1)(C)O)C(C)C
InChI
InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15-/m0/s1
InChIKey
LHYHMMRYTDARSZ-AJNGGQMLSA-N
Chemical Structure
2D Structure
2D structure of epi-alpha-Muurolol
CAS: 19912-62-0
CID: 3084331
Formula: C15H26O
MW: 222.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight222.37
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass222.198365449
Monoisotopic Mass222.198365449
Topological Polar Surface Area20.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity292
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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