2-(3,4-Dihydroxyphenyl)-2-[[2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy...
C30H26O13
20347-71-1 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  43 48 0 0 0
M  V30 BEGIN ATOM
M  V30 1 O 6.0236 6.6684 0.0 0
M  V30 2 O 2.6268 8.4652 0.0 0
M  V30 3 O 3.1616 11.4986 0.0 0
M  V30 4 O 0.0000 7.0757 0.0 0
M  V30 5 O 0.5348 4.0425 0.0 0
M  V30 6 O 4.8761 13.5418 0.0 0
M  V30 7 O 10.1298 12.6154 0.0 0
M  V30 8 O 9.8736 10.6694 0.0 0
M  V30 9 O 8.3336 0.0000 0.0 0
M  V30 10 O 5.2536 0.0000 0.0 0
M  V30 11 O 14.4936 8.0021 0.0 0
M  V30 12 C 5.2536 8.0021 0.0 0
M  V30 13 O 6.7007 8.5288 0.0 0
M  V30 14 C 4.0739 8.9921 0.0 0
M  V30 15 C 6.9682 10.0454 0.0 0
M  V30 16 C 4.3413 10.5087 0.0 0
M  V30 17 C 5.7884 11.0353 0.0 0
M  V30 18 C 8.4153 10.5721 0.0 0
M  V30 19 C 6.0559 12.5519 0.0 0
M  V30 20 C 8.6827 12.0887 0.0 0
M  V30 21 C 7.5030 13.0786 0.0 0
M  V30 22 C 4.0739 7.0122 0.0 0
M  V30 23 C 2.6268 7.5389 0.0 0
M  V30 24 C 4.3413 5.4956 0.0 0
M  V30 25 C 1.4471 6.5490 0.0 0
M  V30 26 C 3.1616 4.5057 0.0 0
M  V30 27 C 1.7145 5.0324 0.0 0
M  V30 28 C 7.5636 6.6684 0.0 0
M  V30 29 C 8.3336 5.3347 0.0 0
M  V30 30 C 8.3336 8.0021 0.0 0
M  V30 31 O 9.8736 5.3347 0.0 0
M  V30 32 C 9.8736 8.0021 0.0 0
M  V30 33 C 10.6436 6.6684 0.0 0
M  V30 34 C 10.6436 9.3358 0.0 0
M  V30 35 C 12.1836 6.6684 0.0 0
M  V30 36 C 12.1836 9.3358 0.0 0
M  V30 37 C 12.9536 8.0021 0.0 0
M  V30 38 C 7.5636 4.0011 0.0 0
M  V30 39 C 8.3336 2.6674 0.0 0
M  V30 40 C 6.0236 4.0011 0.0 0
M  V30 41 C 7.5636 1.3336 0.0 0
M  V30 42 C 5.2536 2.6674 0.0 0
M  V30 43 C 6.0236 1.3336 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 12
M  V30 2 1 1 28
M  V30 3 1 2 14
M  V30 4 1 3 16
M  V30 5 1 4 25
M  V30 6 1 5 27
M  V30 7 1 6 19
M  V30 8 1 7 20
M  V30 9 1 8 34
M  V30 10 1 9 41
M  V30 11 1 10 43
M  V30 12 1 11 37
M  V30 13 1 12 13
M  V30 14 1 12 14
M  V30 15 1 12 22
M  V30 16 1 13 15
M  V30 17 1 14 16
M  V30 18 1 15 17
M  V30 19 2 15 18
M  V30 20 1 16 17
M  V30 21 2 17 19
M  V30 22 1 18 20
M  V30 23 1 19 21
M  V30 24 2 20 21
M  V30 25 2 22 23
M  V30 26 1 22 24
M  V30 27 1 23 25
M  V30 28 2 24 26
M  V30 29 2 25 27
M  V30 30 1 26 27
M  V30 31 1 28 29
M  V30 32 1 28 30
M  V30 33 1 29 31
M  V30 34 1 29 38
M  V30 35 1 30 32
M  V30 36 1 31 33
M  V30 37 1 32 33
M  V30 38 2 32 34
M  V30 39 2 33 35
M  V30 40 1 34 36
M  V30 41 1 35 37
M  V30 42 2 36 37
M  V30 43 2 38 39
M  V30 44 1 38 40
M  V30 45 1 39 41
M  V30 46 2 40 42
M  V30 47 2 41 43
M  V30 48 1 42 43
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
20347-71-1

> <cas.index.name>
2H-1-Benzopyran-3,4,5,7-tetrol, 2-(3,4-dihydroxyphenyl)-2-[[2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl]oxy]-3,4-dihydro-

> <molecular.formula>
C30H26O13

> <molecular.weight>
594.52

> <boiling.point.predicted>
986.4±65.0 °C    Press: 760 Torr

> <density.predicted>
1.87±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
9.24±0.70    Most Acidic Temp: 25 °C

$$$$
