(4E,6E)-1,7-bis(3,4-dihydroxyphenyl)hepta-4,6-dien-3-one

PubChem CID: 10426520

Connections displayed (default: 10).

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Compound Synonyms	SCHEMBL8741647, CHEMBL2346808
Topological Polar Surface Area	98.0
Hydrogen Bond Donor Count	4.0
Heavy Atom Count	24.0
Isotope Atom Count	0.0
Molecular Complexity	459.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	(4E,6E)-1,7-bis(3,4-dihydroxyphenyl)hepta-4,6-dien-3-one
Prediction Hob	1.0
Xlogp	3.1
Molecular Formula	C19H18O5
Prediction Swissadme	0.0
Inchi Key	VJJPCEDEDJXHHK-ZPUQHVIOSA-N
Fcsp3	0.1052631578947368
Logs	-2.948
Rotatable Bond Count	6.0
Logd	2.926
Compound Name	(4E,6E)-1,7-bis(3,4-dihydroxyphenyl)hepta-4,6-dien-3-one
Prediction Hob Swissadme	0.0
Exact Mass	326.115
Formal Charge	0.0
Monoisotopic Mass	326.115
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	326.3
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	2.0
Esol	-3.815557600000001
Inchi	InChI=1S/C19H18O5/c20-15(8-5-14-7-10-17(22)19(24)12-14)4-2-1-3-13-6-9-16(21)18(23)11-13/h1-4,6-7,9-12,21-24H,5,8H2/b3-1+,4-2+
Smiles	C1=CC(=C(C=C1CCC(=O)/C=C/C=C/C2=CC(=C(C=C2)O)O)O)O
Nring	2.0
Defined Bond Stereocenter Count	2.0

1. Outgoing r'ship FOUND_IN to/from Achillea Sibirica (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Alnus Alnobetula (Plant) Rel Props:Reference:
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10. Outgoing r'ship FOUND_IN to/from Alnus Sieboldiana (Plant) Rel Props:Reference:
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17. Outgoing r'ship FOUND_IN to/from Amomum Kravanh (Plant) Rel Props:Source_db:npass_chem_all
18. Outgoing r'ship FOUND_IN to/from Amomum Krervanh (Plant) Rel Props:Reference:
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38. Outgoing r'ship FOUND_IN to/from Dioscorea Cirrhosa (Plant) Rel Props:Reference:
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40. Outgoing r'ship FOUND_IN to/from Dioscorea Communis (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Dioscorea Composita (Plant) Rel Props:Reference:
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46. Outgoing r'ship FOUND_IN to/from Dioscorea Futschauensis (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Dioscorea Glabra (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Dioscorea Gracillima (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Dioscorea Hamiltonii (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Dioscorea Hispida (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Dioscorea Japonica (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Dioscorea Nipponica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
53. Outgoing r'ship FOUND_IN to/from Dioscorea Olfersiana (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Dioscorea Opposita (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Dioscorea Oppositifolia (Plant) Rel Props:Reference:
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58. Outgoing r'ship FOUND_IN to/from Dioscorea Pentaphylla (Plant) Rel Props:Reference:
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61. Outgoing r'ship FOUND_IN to/from Dioscorea Puber (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Dioscorea Purpurea (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Dioscorea Rotundata (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Dioscorea Sativa (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Dioscorea Septemloba (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Dioscorea Spongiosa (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Dioscorea Tenuipes (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Dioscorea Tokoro (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Dioscorea Tomentosa (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Dioscorea Villosa (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Dioscorea Wallichi (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Dioscorea Wallichii (Plant) Rel Props:Reference:
73. Outgoing r'ship FOUND_IN to/from Dioscorea Zingiberensis (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Dumortiera Hirsuta (Plant) Rel Props:Reference:
75. Outgoing r'ship FOUND_IN to/from Elaichi Amomum (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Frangula Alnus (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Grewia Hirsuta (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Herniaria Hirsuta (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Indigofera Hirsuta (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Iris Sibirica (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Mucuna Hirsuta (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Neanotis Hirsuta (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Persicaria Sibirica (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Pinus Sibirica (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Polygala Sibirica (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Primula Hirsuta (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Prunus Sibirica (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Senna Hirsuta (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Sideritis Hirsuta (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Tylophora Hirsuta (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Uncaria Hirsuta (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Vicia Hirsuta (Plant) Rel Props:Reference:

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(4E,6E)-1,7-bis(3,4-dihydroxyphenyl)hepta-4,6-dien-3-one

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Phytochemical Properties

Associated Connections 92

Plant Connections 92