Isobellidifolin

PubChem CID: 5322042

Connections displayed (default: 10).

Loading graph...

ℹ️ Click here to know more about the properties

Compound Synonyms	Isobellidifolin, 1,3,8-trihydroxy-5-methoxyxanthen-9-one, 1,3,8-trihydroxy-5-methoxyxanthone, 552-00-1, HY-N9370, 5-Methoxy-1,3,8-trihyroxyxanthen-9-one, DA-54400, 1,3,8-trihydroxy-5-methoxy-xanthen-9-one, CS-0159552, E89029
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	96.2
Hydrogen Bond Donor Count	3.0
Pfizer 3 75 Rule	True
Scaffold Graph Level	CC1C2CCCCC2CC2CCCCC21
Np Classifier Class	Plant xanthones
Deep Smiles	COcccccc6occcO)ccc6c%10=O)))O)))))))))O
Heavy Atom Count	20.0
Classyfire Class	Benzopyrans
Scaffold Graph Node Level	OC1C2CCCCC2OC2CCCCC21
Classyfire Subclass	1-benzopyrans
Isotope Atom Count	0.0
Molecular Complexity	386.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	1,3,8-trihydroxy-5-methoxyxanthen-9-one
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Xlogp	2.4
Gsk 4 400 Rule	True
Molecular Formula	C14H10O6
Scaffold Graph Node Bond Level	O=c1c2ccccc2oc2ccccc12
Prediction Swissadme	0.0
Inchi Key	QNJCJDZKEAVOBJ-UHFFFAOYSA-N
Silicos It Class	Soluble
Fcsp3	0.0714285714285714
Logs	-3.584
Rotatable Bond Count	1.0
Logd	2.425
Synonyms	1,3,8-trihydroxy-5-methoxy xanthone, 1,3,8-trihydroxy-5-methoxy-xanthone, 1,3,8-trihydroxy-5-methoxyxanthone, isobellidifolin
Esol Class	Soluble
Functional Groups	c=O, cO, cOC, coc
Compound Name	Isobellidifolin
Prediction Hob Swissadme	0.0
Exact Mass	274.048
Formal Charge	0.0
Monoisotopic Mass	274.048
Hydrogen Bond Acceptor Count	6.0
Molecular Weight	274.22
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-3.8570136
Inchi	InChI=1S/C14H10O6/c1-19-9-3-2-7(16)12-13(18)11-8(17)4-6(15)5-10(11)20-14(9)12/h2-5,15-17H,1H3
Smiles	COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C(C=C3O2)O)O
Nring	3.0
Np Classifier Biosynthetic Pathway	Polyketides, Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Xanthones

1. Outgoing r'ship FOUND_IN to/from Aglaia Laxiflora (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Andropogon Hallii (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Androsace Umbellata (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Artemisia Sylvatica (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Balanophora Laxiflora (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Berberis Umbellata (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Callicarpa Cana (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Caralluma Umbellata (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Cedronella Canariensis (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Centaurea Cana (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Crotalaria Umbellata (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Derris Amazonica (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Derris Benthamii (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Derris Brevipes (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Derris Elliptica (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Derris Eriocarpa (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Derris Ferruginea (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Derris Indica (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Derris Malaccensis (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Derris Reticulata (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Derris Robusta (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Derris Scandens (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Derris Trifoliata (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Derris Uliginosa (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Diospyros Sylvatica (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Erica Umbellata (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Euphorbia Umbellata (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Fagus Sylvatica (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Gynochthodes Umbellata (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Hedyotis Umbellata (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Hunteria Zeylanica (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Hydrangea Umbellata (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Isodon Eriocalyx (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Lindera Umbellata (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Mangifera Sylvatica (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Merremia Umbellata (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Meyna Laxiflora (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Morinda Umbellata (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Nyssa Sylvatica (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Oldenlandia Umbellata (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Pavonia Odorata (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Pavonia Zeylanica (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Podocarpus Hallii (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Rapanea Umbellata (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Rhynchosia Cana (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Salvia Cana (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Stachys Sylvatica (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Stillingia Sylvatica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
49. Outgoing r'ship FOUND_IN to/from Swertia Chirata (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279
50. Outgoing r'ship FOUND_IN to/from Swertia Chirayita (Plant) Rel Props:Reference:ISBN:9788185042084
51. Outgoing r'ship FOUND_IN to/from Swertia Paniculata (Plant) Rel Props:Reference:ISBN:9788185042114
52. Outgoing r'ship FOUND_IN to/from Tephrosia Apollinea (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Tephrosia Candida (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Tephrosia Falciformis (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Tephrosia Maxima (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Tephrosia Pumila (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Tephrosia Purpurea (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Tephrosia Spinosa (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Tephrosia Uniflora (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Tephrosia Villosa (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Tephrosia Vogelii (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Valeriana Laxiflora (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Vigna Umbellata (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Viola Sylvatica (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Zehneria Umbellata (Plant) Rel Props:Reference:

Back to Browse Back to Home

GRAYU Website

Grayu

Isobellidifolin

Graph

Phytochemical Properties

Associated Connections 65

Plant Connections 65