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(±) -Narwedine (±-Galanthaminone)

CAT: 1299-RM-G011207-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-G011207-01Size:10 mg
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CAS Number
1668-86-6
Synonyms
(4aS,8aS) -3-methoxy-11-methyl-9,10,11,12-tetrahydro-4aH-benzo[2,3]benzofuro[4,3-cd]azepin-6 (5H) -one/ (4aR,8aR) -3-methoxy-11-methyl-9,10,11,12-tetrahydro-4aH-benzo[2,3]benzofuro[4,3-cd]azepin-6 (5H) -one
Molecular Formula
C17H19NO3
Molecular Weight
285.34
Target Alternative Name
Narwedine; Galanthaminone
Product Name Synonym
(4aS,8aS) -3-methoxy-11-methyl-9,10,11,12-tetrahydro-4aH-benzo[2,3]benzofuro[4,3-cd]azepin-6 (5H) -one/ (4aR,8aR) -3-methoxy-11-methyl-9,10,11,12-tetrahydro-4aH-benzo[2,3]benzofuro[4,3-cd]azepin-6 (5H) -one

Chemical Information

Narwedine

Narwedine is a benzazepine.

CAS Number1668-86-6
PubChem CID10356588
IUPAC Name(1S,12S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-one
Molecular FormulaC17H19NO3
Molecular Weight285.34
XLogP1.7
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity477
SMILES
CN1CC[C@@]23C=CC(=O)C[C@@H]2OC4=C(C=CC(=C34)C1)OC
InChI
InChI=1S/C17H19NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,14H,7-10H2,1-2H3/t14-,17-/m0/s1
InChIKey
QENVUHCAYXAROT-YOEHRIQHSA-N
Chemical Structure
2D Structure
2D structure of Narwedine
CAS: 1668-86-6
CID: 10356588
Formula: C17H19NO3
MW: 285.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight285.34
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass285.13649347
Monoisotopic Mass285.13649347
Topological Polar Surface Area38.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity477
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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