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36338-96-2,MFCD00151135
Catalog No.:AA00BY2O

36338-96-2 | Safflower yellow

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
color value 30 (E1%,1cm,5)
in stock  
$6.00   $4.00
- +
50mg
color value 30 (E1%,1cm,5)
in stock  
$8.00   $6.00
- +
250mg
color value 30 (E1%,1cm,5)
in stock  
$11.00   $8.00
- +
1g
color value 30 (E1%,1cm,5)
in stock  
$13.00   $9.00
- +
5g
color value 30 (E1%,1cm,5)
in stock  
$35.00   $25.00
- +
100g
color value 30 (E1%,1cm,5)
in stock  
$351.00   $246.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BY2O
Chemical Name:
Safflower yellow
CAS Number:
36338-96-2
Molecular Formula:
C43H42O22
Molecular Weight:
910.7804
MDL Number:
MFCD00151135
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)[C@]1(O)C(=C(/C=C\2/C(=O)C(=C([C@@](C2=O)(O)[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)O)C(=O)/C=C/c2ccc(cc2)O)C(=O)C(=C1O)C(=O)/C=C/c1ccc(cc1)O)O
Properties
Computed Properties
 
Complexity:
2100  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
12  
Defined Bond Stereocenter Count:
3  
Heavy Atom Count:
65  
Hydrogen Bond Acceptor Count:
22  
Hydrogen Bond Donor Count:
15  
Rotatable Bond Count:
11  
XLogP3:
-2.5  

Downstream Synthesis Route
(3S,3'S)-1-5-(p-acetoxycinnamoyl)-3-C-(β-D-2'',3'',4'',6''-tetra-O-acetylglucopyranosyl)-3,4-dihydroxy-2,6-dioxocyclohex-4-enylidene-1'-5'-(p-acetoxycinnamoyl)-3'-C-(β-D-2''',3''',4''',6'''-tetra-O-acetylglucosyl)-2',3',4'-trihydroxy-6'-oxocyclohexa-1',4'-dienylmethane 
  36338-96-2 

[1]Abe,Yuka;Sohtome,Takuo;Sato,Shingo[JournalofHeterocyclicChemistry,2020,vol.57,#10,p.3685-3690]

Literature
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SDS
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Tags:36338-96-2 Molecular Formula|36338-96-2 MDL|36338-96-2 SMILES|36338-96-2 Safflower yellow