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(-​) ​-​Salutaridine

CAT: 0013-GTR19169545-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19169545-02Size:10 mg
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Description
(-​) ​-​Salutaridine
CAS Number
4090-18-0
Product Name Alternative
(​) ​​Salutaridine, (​) ​ ​Salutaridine, Salutaridine, SINOACUTINE
Purity
98.00% (May vary between batches)
Solubility
DMSO:60 mg/mL (183.28 mM)
Smiles
OC1=C2[C@]34C ([C@] (CC2=CC=C1OC) (N (C) CC3) [H]) =CC (=O) C (OC) =C4
Molecular Formula
C19H21NO4
Molecular Weight
327.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Salutaridine, (-)-

(-)-salutaridine has been reported in Stephania yunnanensis, Stephania cephalantha, and other organisms with data available.

CAS Number4090-18-0
PubChem CID821366
IUPAC Name(1R,9S)-3-hydroxy-4,13-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5,10,13-pentaen-12-one
Molecular FormulaC19H21NO4
Molecular Weight327.4
XLogP1.9
Topological Polar Surface Area59
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity612
SMILES
CN1CC[C@@]23C=C(C(=O)C=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC
InChI
InChI=1S/C19H21NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13,22H,6-8H2,1-3H3/t13-,19+/m0/s1
InChIKey
GVTRUVGBZQJVTF-ORAYPTAESA-N
Chemical Structure
2D Structure
2D structure of Salutaridine, (-)-
CAS: 4090-18-0
CID: 821366
Formula: C19H21NO4
MW: 327.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight327.4
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass327.14705815
Monoisotopic Mass327.14705815
Topological Polar Surface Area59 Ų
Heavy Atom Count24
Formal Charge0
Complexity612
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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