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(19Z) -Normacusine B

CAT: 0804-HY-N1597Size: 1 EachDry Ice: NoHazardous: No
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Description
(19Z) -Normacusine B, Gelsemiurn alkaloids, is a natural product that can be isolated from Gelsemiurn[1].
CAS Number
124096-81-7
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/19z-normacusine-b.html
Solubility
10 mM in DMSO
Smiles
OC[C@H]1[C@@]2([H])[N@@](C/3)[C@](C[C@H]1C3=C\C)([H])C4=C(C2)C5=CC=CC=C5N4
Molecular Formula
C19H22N2O
Molecular Weight
294.39
References & Citations
[1]Mariko Kitajima, et al. Stereoselective transformation of ajmaline into three minor Gelsemium alkaloids, koumidine, (19Z) -anhydrovobasinediol [ (19Z) -taberpsychine] and N-demethoxyrankinidine and their absolute configuration. Journal of the Chemical Society. 1991,8.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

16-Epinormacusine B

16-Epinormacusine B has been reported in Alstonia yunnanensis, Vinca difformis, and other organisms with data available.

CAS Number124096-81-7
PubChem CID626363
IUPAC Name(15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl)methanol
Molecular FormulaC19H22N2O
Molecular Weight294.4
XLogP2.1
Topological Polar Surface Area39.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity490
SMILES
CC=C1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)CO
InChI
InChI=1S/C19H22N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,13,15,17-18,20,22H,7-10H2,1H3
InChIKey
VXTDUGOBAOLMED-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 16-Epinormacusine B
CAS: 124096-81-7
CID: 626363
Formula: C19H22N2O
MW: 294.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.4
XLogP32.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass294.173213330
Monoisotopic Mass294.173213330
Topological Polar Surface Area39.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity490
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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HY-CE00081(19Z,22Z,25Z,28Z) -3-Oxotetratriacontatetraenoyl-CoA
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Alternative Products

CatalogName
TCL-00062-01Methyl (13Z,16Z,19Z) -docosatrienoate
FE179935Ethyl (7Z,10Z,13Z,16Z,19Z) -docosapentaenoate
sc-2007867Z,10Z,13Z,16Z,19Z-Docosapentaenoic acid
TXB-00647-01(7Z,10Z,13Z,16Z,19Z) -Docosapentaenoyl-CoA
MBS392014916Z,19Z,22Z,25Z,28Z-Tetratriacontapentaenoic acid
MBS392014819Z,22Z,25Z,28Z,31Z-Tetratriacontapentaenoic acid
TRC-D484500-10MG(13Z,16Z,19Z)-13,16,19-Docosatrienoic Acid
TYD-02502-01(7Z,10Z,13Z,16Z,19Z) -3-Oxodocosapentaenoyl-CoA
BML-FA012-0010Docosa-7Z,10Z,13Z,16Z,19Z-pentaenoic acid
MBS3920154-0119Z,22Z,25Z,28Z,31Z,34Z-Heptatriacontahexaenoic Acid

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