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Marmin

CAT: 0013-GTR19183326-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19183326-01Size:1 mg
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Description
Marmin exhibits anti-ulcer properties primarily by preserving mucosal barrier integrity and suppressing gastric motility. Its secondary mechanisms involve antagonizing endogenous acetylcholine and histamine effects. This small molecule is utilized in gastrointestinal research, including in vivo ulcer models and in vitro assays investigating smooth muscle contraction and mucosal defense.
CAS Number
14957-38-1
Field of Research
Immunology & Inflammation, Infectious Disease & Virology, Metabolism Research, Neuroscience, Pharmacology & Drug Discovery
Smiles
CC (C) ([C@@H] (CC/C (/C) =C/COc (cc1) cc (O2) c1C=CC2=O) O) O
Molecular Formula
C19H24O5
Molecular Weight
332.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(+)-Marmin

7-{[(2E,6R)-6,7-dihydroxy-3,7-dimethyloct-2-en-1-yl]oxy}chromen-2-one has been reported in Citrus hassaku, Citrus medica, and other organisms with data available.

CAS Number14957-38-1
PubChem CID6450230
IUPAC Name7-[(E,6R)-6,7-dihydroxy-3,7-dimethyloct-2-enoxy]chromen-2-one
Molecular FormulaC19H24O5
Molecular Weight332.4
XLogP3
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count24
Formal Charge0
Complexity494
SMILES
C/C(=C\COC1=CC2=C(C=C1)C=CC(=O)O2)/CC[C@H](C(C)(C)O)O
InChI
InChI=1S/C19H24O5/c1-13(4-8-17(20)19(2,3)22)10-11-23-15-7-5-14-6-9-18(21)24-16(14)12-15/h5-7,9-10,12,17,20,22H,4,8,11H2,1-3H3/b13-10+/t17-/m1/s1
InChIKey
QYYKWTUUCOTGNS-JIIJFUIFSA-N
Chemical Structure
2D Structure
2D structure of (+)-Marmin
CAS: 14957-38-1
CID: 6450230
Formula: C19H24O5
MW: 332.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.4
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass332.16237386
Monoisotopic Mass332.16237386
Topological Polar Surface Area76 Ų
Heavy Atom Count24
Formal Charge0
Complexity494
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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