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139893-43-9,MFCD07773041
Catalog No.:AA001BPD

139893-43-9 | 1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
98%(HPLC)
in stock  
$62.00   $44.00
- +
250mg
95%
in stock  
$86.00   $60.00
- +
1g
95%
in stock  
$140.00   $98.00
- +
5g
95%
in stock  
$397.00   $278.00
- +
25g
95%
in stock  
$1,218.00   $853.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001BPD
Chemical Name:
1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)-
CAS Number:
139893-43-9
Molecular Formula:
C25H43NO6
Molecular Weight:
453.6120
MDL Number:
MFCD07773041
SMILES:
CCC(C(=O)O[C@@H]1C[C@H](C)C=C2[C@@H]1[C@H](CC[C@H](C[C@@H](CC(=O)O)[O-])O)[C@@H](C=C2)C)(C)C.[NH4+]
Properties
Computed Properties
 
Complexity:
694  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
7  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
11  

Downstream Synthesis Route

[1]Patent:US5939564,1999,A

[1]Thaper,RajeshK.;Kumar,Yatendra;Kumar,S.M.Dileep;Misra,Satyananda;Khanna,JagMohan[OrganicProcessResearchandDevelopment,1999,vol.3,#6,p.476-479]

[2]CurrentPatentAssignee:CODEXISINC-US9399785,2016,B2

[3]CurrentPatentAssignee:XINCHANGKANGLECHEMICALSCO.,LTD.-CN104803959,2017,B

[1]Patent:US9399785,2016,B2.Locationinpatent:Page/Pagecolumn26;27

[2]Patent:US9399785,2016,B2

Literature
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SDS
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Tags:139893-43-9 Molecular Formula|139893-43-9 MDL|139893-43-9 SMILES|139893-43-9 1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)-