tanariflavanone D

PubChem CID: 11247668

Connections displayed (default: 10).

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Compound Synonyms	tanariflavanone D, CHEBI:66191, CHEMBL499116, DTXSID501103400, BDBM50278902, 856680-01-8, Q27134726, (2S)-5,7,3',4'-tetrahydroxy-6-(6-hydroxy-3,7-dimethylocta-2',7'-dienyl)-flavanone, (2S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-6-[(2E)-6-hydroxy-3,7-dimethyl-2,7-octadien-1-yl]-4H-1-benzopyran-4-one, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]-2,3-dihydro-4H-chromen-4-one, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dienyl]-2,3-dihydrochromen-4-one
Topological Polar Surface Area	127.0
Hydrogen Bond Donor Count	5.0
Heavy Atom Count	32.0
Isotope Atom Count	0.0
Molecular Complexity	704.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	1.0
Uniprot Id	n.a., P08246
Iupac Name	(2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dienyl]-2,3-dihydrochromen-4-one
Prediction Hob	1.0
Target Id	NPT279
Xlogp	4.8
Molecular Formula	C25H28O7
Prediction Swissadme	1.0
Inchi Key	VALTWXVTFHGVHS-ILVSVAAVSA-N
Fcsp3	0.32
Logs	-3.819
Rotatable Bond Count	7.0
Logd	2.979
Compound Name	tanariflavanone D
Prediction Hob Swissadme	1.0
Exact Mass	440.184
Formal Charge	0.0
Monoisotopic Mass	440.184
Hydrogen Bond Acceptor Count	7.0
Molecular Weight	440.5
Covalent Unit Count	1.0
Total Atom Stereocenter Count	2.0
Total Bond Stereocenter Count	1.0
Esol	-5.423150400000001
Inchi	InChI=1S/C25H28O7/c1-13(2)17(26)8-5-14(3)4-7-16-19(28)11-23-24(25(16)31)21(30)12-22(32-23)15-6-9-18(27)20(29)10-15/h4,6,9-11,17,22,26-29,31H,1,5,7-8,12H2,2-3H3/b14-4+/t17?,22-/m0/s1
Smiles	CC(=C)C(CC/C(=C/CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC(=C(C=C3)O)O)O)/C)O
Nring	3.0
Defined Bond Stereocenter Count	1.0

1. Outgoing r'ship FOUND_IN to/from Acacia Tomentosa (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Achyrocline Tomentosa (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Aglaia Tomentosa (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Ampelocissus Tomentosa (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Anemone Tomentosa (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Bauhinia Tomentosa (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Berlinia Tomentosa (Plant) Rel Props:Reference:
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10. Outgoing r'ship FOUND_IN to/from Casearia Tomentosa (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Catunaregam Tomentosa (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Citrus Grandis (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Cyathula Tomentosa (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Dicoma Tomentosa (Plant) Rel Props:Reference:
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18. Outgoing r'ship FOUND_IN to/from Ficus Tomentosa (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Goupia Tomentosa (Plant) Rel Props:Reference:
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22. Outgoing r'ship FOUND_IN to/from Lespedeza Tomentosa (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Macaranga Bicolor (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Macaranga Conifera (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Macaranga Denticulata (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Macaranga Indica (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Macaranga Peltata (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Macaranga Roxburghi (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Macaranga Sinensis (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Macaranga Tanarius (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
31. Outgoing r'ship FOUND_IN to/from Macaranga Triloba (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Mallotus Tanarius (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Melochia Tomentosa (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Morinda Tomentosa (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Myrtus Tomentosa (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Paulownia Tomentosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
37. Outgoing r'ship FOUND_IN to/from Pluchea Tomentosa (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Populus Tomentosa (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Premna Tomentosa (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Prunus Tomentosa (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Rhodomyrtus Tomentosa (Plant) Rel Props:Reference:
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47. Outgoing r'ship FOUND_IN to/from Tinospora Tomentosa (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Trema Tomentosa (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Uncaria Tomentosa (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Vitis Tomentosa (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Wrightia Tomentosa (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Xantolis Tomentosa (Plant) Rel Props:Reference:

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tanariflavanone D

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Phytochemical Properties

Associated Connections 52

Plant Connections 52