(2S)-7-hydroxy-2-[3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one

PubChem CID: 11995581

Connections displayed (default: 10).

Loading graph...

ℹ️ Click here to know more about the properties

Compound Synonyms	CHEMBL513212, BDBM50241805, 7-hydroxy-4''-methoxy-3''-(3-hydroxy-3-methyl-trans-but-1-enyl)-5''-(3-methylbut-2-enyl)flavanone
Topological Polar Surface Area	76.0
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	31.0
Isotope Atom Count	0.0
Molecular Complexity	677.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	1.0
Uniprot Id	P18031
Iupac Name	(2S)-7-hydroxy-2-[3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one
Prediction Hob	1.0
Xlogp	4.8
Molecular Formula	C26H30O5
Prediction Swissadme	1.0
Inchi Key	SRFNFECUBWLUHV-YSESTWPTSA-N
Fcsp3	0.3461538461538461
Logs	-3.996
Rotatable Bond Count	6.0
Logd	3.8
Compound Name	(2S)-7-hydroxy-2-[3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one
Prediction Hob Swissadme	1.0
Exact Mass	422.209
Formal Charge	0.0
Monoisotopic Mass	422.209
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	422.5
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	1.0
Esol	-5.374081812903226
Inchi	InChI=1S/C26H30O5/c1-16(2)6-7-17-12-19(13-18(25(17)30-5)10-11-26(3,4)29)23-15-22(28)21-9-8-20(27)14-24(21)31-23/h6,8-14,23,27,29H,7,15H2,1-5H3/b11-10+/t23-/m0/s1
Smiles	CC(=CCC1=C(C(=CC(=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3)O)/C=C/C(C)(C)O)OC)C
Nring	3.0
Defined Bond Stereocenter Count	1.0

1. Outgoing r'ship FOUND_IN to/from Albizia Procera (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Anthocleista Procera (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Balanophora Fungosa (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Balanophora Harlandii (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Balanophora Indica (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Balanophora Involucrata (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Balanophora Japonica (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Balanophora Laxiflora (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Balanophora Occidentals (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Balanophora Polyandra (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Calotropis Gigantea (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Calotropis Procera (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
13. Outgoing r'ship FOUND_IN to/from Cephalaria Procera (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Ephedra Procera (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Erythrina Abyssinica (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Erythrina Americana (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Erythrina Arborescens (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Erythrina Berteroana (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Erythrina Burttii (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Erythrina Chiriquensis (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Erythrina Folkersii (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Erythrina Fusca (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Erythrina Glauca (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Erythrina Hypaphorus (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Erythrina Latissima (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Erythrina Lithosperma (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Erythrina Lysistemon (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Erythrina Melanacantha (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Erythrina Orientalis (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Erythrina Pallida (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Erythrina Poeppigiana (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Erythrina Resupinata (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Erythrina Sacleuxii (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Erythrina Salviiflora (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Erythrina Sandwicensis (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Erythrina Senegalensis (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Erythrina Sigmoidea (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Erythrina Speciosa (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Erythrina Stricta (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Erythrina Suberosa (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Erythrina Subumbrans (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Erythrina Variegata (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Erythrina Variegate (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Erythrina Vogelii (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Juniperus Procera (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Pedicularis Procera (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Roscoea Procera (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Terminalia Procera (Plant) Rel Props:Reference:

Back to Browse Back to Home

GRAYU Website

Grayu

(2S)-7-hydroxy-2-[3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one

Graph

Phytochemical Properties

Associated Connections 48

Plant Connections 48