Chanoclavine II

Base Information

Chemical Name:Chanoclavine II
CAS No.:1466-08-6
Molecular Formula:C₁₆H₂₀N₂O
Molecular Weight:256.348
Hs Code.:
UNII:3ZLN2ZRI6Q
DSSTox Substance ID:DTXSID10932863
Metabolomics Workbench ID:116371
Nikkaji Number:J13.850I
Wikidata:Q15410882
Wikipedia:Chanoclavine_II
Mol file:1466-08-6.mol

Synonyms:Chanoclavine II;1466-08-6;UNII-3ZLN2ZRI6Q;3ZLN2ZRI6Q;(E)-2-methyl-3-[(4R,5S)-4-(methylamino)-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]prop-2-en-1-ol;2-Propen-1-o1, 2-methyl-3-(1,3,4,5-tetrahydro-4-(methylamino)benz(cd)indol-5-yl)-, (4R-(4alpha,5alpha(E)))-;(E)-2-Methyl-3-[1,3,4,5-tetrahydro-4beta-(methylamino)benzo[cd]indole-5beta-yl]-2-propene-1-ol;CHANOCLAVIN II;CHANOCLAVINE-II;DTXSID10932863;CHEBI:200025;CHANOCLAVINE EPIMER AT POSITION 10;CHANOCLAVINE EPIMER AT POSITION 10 [MI];Q15410882;2-PROPEN-1-OL, 2-METHYL-3-((4R,5S)-1,3,4,5-TETRAHYDRO-4-(METHYLAMINO)BENZ(CD)INDOL-5-YL)-, (2E)-

Suppliers and Price of Chanoclavine II

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of Chanoclavine II

Chemical Property:

PSA：48.05000
LogP:2.72510
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:256.157563266
Heavy Atom Count:19
Complexity:355

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CC1C(CC2=CNC3=CC=CC1=C23)NC)CO
Isomeric SMILES:C/C(=C\[C@@H]1[C@@H](CC2=CNC3=CC=CC1=C23)NC)/CO

Technology Process of Chanoclavine II

There total 103 articles about Chanoclavine II which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

: 106507-95-3,106566-47-6,111467-77-7,118760-11-5
(E)-4,5-trans-5-(2-hydroxymethyl-1-propen-1-yl)-4-methoxycarbonylamino-1,3,4,5-tetrahydrobenz[cd]indole

: 1150-43-2,1150-44-3,1466-08-6,2390-99-0,57550-19-3,76109-09-6,109668-52-2,111427-26-0,118760-09-1,11012-16-1
(+/-)-chanoclavine I

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran;

Reference yield: 95.0%

: 133738-27-9
(E)-3-((4S,5S)-4-Methoxycarbonylamino-1,3,4,5-tetrahydro-benzo[cd]indol-5-yl)-2-methyl-acrylic acid methyl ester

: 1150-43-2,1150-44-3,1466-08-6,2390-99-0,57550-19-3,76109-09-6,109668-52-2,111427-26-0,118760-09-1,11012-16-1
(+/-)-chanoclavine I

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran;
DOI:10.3987/COM-90-5577

Reference yield: 88.0%

: C₃₀H₃₂N₂O₅S₂

: 1150-43-2,1150-44-3,1466-08-6,2390-99-0,57550-19-3,76109-09-6,109668-52-2,111427-26-0,118760-09-1,11012-16-1
(+)-chanoclavine-I

Guidance literature:: With naphthalene; sodium; In tetrahydrofuran; at -78 ℃; for 0.166667h; Inert atmosphere;
DOI:10.1021/acs.orglett.7b03683