I01-0114 (+)-Dibenzoyl-D-tartaric acid monohydrate (CAS# 80822-15-7)

(+)-Dibenzoyl-D-tartaric acid monohydrate 80822-15-7

General Information
Catalog No.:	I01-0114
Synonym:	(+)-O,O'-Dibenzoyl-D-tartaric acid monohydrate; 2,3-Di-O-benzoyl-D-tartaric acid hydrate
Cas#:	80822-15-7
MDL# :	MFCD00150722
Molecular Formula:	C18H14O8.H2O
Mole Weight:	376.31

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Search Formula C18H14O8.H2O in google

O=C(O)[C@H]([C@@H](C(O)=O)OC(C2=CC=CC=C2)=O)OC(C1=CC=CC=C1)=O.[H]O[H]
  CDK  02081216552D

29 29  0  0  0  0            999 V2000
   -0.7145   -0.1375    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.1375    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1227   -1.4437    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083   -1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6938   -1.4437    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083   -0.2062    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.6938    0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9793   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9793   -1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2648    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5504   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8359    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8359    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5504    1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2648    1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1227    0.2063    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.8372   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5517    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5517    1.0313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2661   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9806    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6951   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6951   -1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9806   -1.4437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2661   -1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1227    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8372    1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083    1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  1  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 11 16  1  0  0  0  0
  7 17  1  0  0  0  0
 17 18  1  1  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 21 26  1  0  0  0  0
 17 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
M  END

I01-0114 (+)-Dibenzoyl-D-tartaric acid monohydrate (CAS# 80822-15-7)

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