Batrachotoxinin A

Base Information Edit

Chemical Name:Batrachotoxinin A
CAS No.:19457-37-5
Molecular Formula:C24H35 N O5
Molecular Weight:417.546
Hs Code.:
UNII:962FMM1ISF
Wikidata:Q76422739
Mol file:19457-37-5.mol

Synonyms:BATRACHOTOXININ A;19457-37-5;962FMM1ISF;(1R,5R,6S,9R,11S,12R,14R)-22-[(1S)-1-hydroxyethyl]-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-diene-9,12-diol;UNII-962FMM1ISF;BATRACHOTOXININ A [MI];(5AR-(5A.ALPHA.,7A.BETA.,9.ALPHA.,11A.BETA.,11B.ALPHA.,12.ALPHA.,13A.ALPHA.,14(S*)))-1,2,3,4,7A,10,11,11A,12,13-DECAHYDRO-14-(1-HYDROXYETHYL)-2,11A-DIMETHYL-7H-9,11B-EPOXY-13A,5A-PROPENOPHENANTHRO(2,1-F)(1,4)OXAZEPINE-9,12(8H)-DIOL;7H-9,11B-EPOXY-13A,5A-PROPENOPHENANTHRO(2,1-F)(1,4)OXAZEPINE-9,12(8H)-DIOL, 1,2,3,4,7A,10,11,11A,12,13-DECAHYDRO-14-((1S)-1-HYDROXYETHYL)-2,11A-DIMETHYL-, (5AR,7AR,9R,11AS,11BS,12R,13AR)-

Suppliers and Price of Batrachotoxinin A

Supply Marketing:Edit

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

Manufacturers and distributors:

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Chemical Property of Batrachotoxinin A Edit

Chemical Property:

Vapor Pressure:3.59E-18mmHg at 25°C
Boiling Point:623.7°Cat760mmHg
Flash Point:331°C
PSA：82.39000
Density:1.34g/cm³
LogP:1.68110
XLogP3:-0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:417.25152322
Heavy Atom Count:30
Complexity:857

Purity/Quality:

Safty Information:

Pictogram(s):
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MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C1=CCC23C1(CC(C45C2=CCC6C4(CCC(C6)(O5)O)C)O)CN(CCO3)C)O
Isomeric SMILES:C[C@@H](C1=CC[C@@]23[C@@]1(C[C@H]([C@@]45C2=CC[C@H]6[C@@]4(CC[C@](C6)(O5)O)C)O)CN(CCO3)C)O

Technology Process of Batrachotoxinin A

There total 5 articles about Batrachotoxinin A 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: