(??) -Huperzine A 5mg

CAT: 0628-A21003-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0628-A21003-5Size:5 mg

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CAS Number

120786-18-7

Chemical Information

Acanthus ilicifolius Linn

LSM-1581 has been reported in Huperzia serrata with data available.

CAS Number	120786-18-7
PubChem CID	1253
IUPAC Name	1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-one
Molecular Formula	C15H18N2O
Molecular Weight	242.32
XLogP	0
Topological Polar Surface Area	55.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	18
Formal Charge	0
Complexity	551

SMILES

CC=C1C2CC3=C(C1(CC(=C2)C)N)C=CC(=O)N3

InChI

InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)

InChIKey

ZRJBHWIHUMBLCN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 120786-18-7

CID: 1253

Formula: C15H18N2O

MW: 242.32

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	242.32
XLogP3	0
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	242.141913202
Monoisotopic Mass	242.141913202
Topological Polar Surface Area	55.1 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	551
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes