Swertifrancheside

PubChem CID: 5464386

Connections displayed (default: 10).

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Compound Synonyms	Swertifrancheside, 155740-03-7, 2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-8-yl]-1,4,8-trihydroxy-6-methoxyxanthen-9-one, CHEBI:66537, 9H-Xanthen-9-one, 2-(2-(3,4-dihydroxyphenyl)-6-beta-D-glucopyranosyl-5,7-dihydroxy-4-oxo-4H-1-benzopyran-8-yl)-1,4,8-trihydroxy-6-methoxy-, CHEMBL504840, DTXSID00165961, BDBM50412092, Q27135145, (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-8-(1,4,8-trihydroxy-6-methoxy-9-oxo-9H-xanthen-2-yl)-4H-chromen-6-yl]-D-glucitol, 1,5,8-Trihydroxy-3-methoxy-7-(5',7',3'',4''-tetrahydroxy-6'-C-beta-D-glucopyranosyl-4'-oxy-8'-flavyl)xanthone, 2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]chromen-8-yl]-1,4,8-trihydroxy-6-methoxy-xanthen-9-one
Topological Polar Surface Area	294.0
Hydrogen Bond Donor Count	11.0
Heavy Atom Count	52.0
Isotope Atom Count	0.0
Molecular Complexity	1360.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	5.0
Uniprot Id	Q72547, P06746
Iupac Name	2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-8-yl]-1,4,8-trihydroxy-6-methoxyxanthen-9-one
Prediction Hob	0.0
Target Id	NPT59
Xlogp	2.0
Molecular Formula	C35H28O17
Prediction Swissadme	0.0
Inchi Key	JAANJQNFIJSRTK-KYRPIRIWSA-N
Fcsp3	0.2
Logs	-4.701
Rotatable Bond Count	5.0
Logd	1.184
Compound Name	Swertifrancheside
Prediction Hob Swissadme	0.0
Exact Mass	720.133
Formal Charge	0.0
Monoisotopic Mass	720.133
Hydrogen Bond Acceptor Count	17.0
Molecular Weight	720.6
Covalent Unit Count	1.0
Total Atom Stereocenter Count	5.0
Total Bond Stereocenter Count	0.0
Esol	-5.494493476923079
Inchi	InChI=1S/C35H28O17/c1-49-11-5-15(39)22-19(6-11)51-33-17(41)7-12(26(42)24(33)29(22)45)21-28(44)25(35-32(48)31(47)27(43)20(9-36)52-35)30(46)23-16(40)8-18(50-34(21)23)10-2-3-13(37)14(38)4-10/h2-8,20,27,31-32,35-39,41-44,46-48H,9H2,1H3/t20-,27-,31+,32-,35+/m1/s1
Smiles	COC1=CC(=C2C(=C1)OC3=C(C=C(C(=C3C2=O)O)C4=C5C(=C(C(=C4O)[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C(=O)C=C(O5)C7=CC(=C(C=C7)O)O)O)O
Nring	7.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Sophora Franchetiana (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Swertia Alata (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Swertia Angustifolia (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Swertia Bimaculata (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Swertia Calycina (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Swertia Chinensis (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Swertia Chirata (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Swertia Chirayita (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Swertia Ciliata (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Swertia Cincta (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Swertia Cordata (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Swertia Corymbosa (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Swertia Decora (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Swertia Decussata (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Swertia Delavayi (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Swertia Densiflora (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Swertia Dilatata (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Swertia Erythrosticta (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Swertia Fasciculata (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Swertia Franchetiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
21. Outgoing r'ship FOUND_IN to/from Swertia Hickinii (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Swertia Japonica (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Swertia Kouitchensis (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Swertia Lawii (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Swertia Leduci (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Swertia Leducii (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Swertia Lloydioides (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Swertia Macrosperma (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Swertia Minor (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Swertia Mussotii (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Swertia Nervosa (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Swertia Paniculata (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Swertia Patens (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Swertia Perennis (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Swertia Petiolata (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Swertia Pseudochinensis (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Swertia Pubescens (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Swertia Pulchella (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Swertia Punctata (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Swertia Punicea (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Swertia Purpurascens (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Swertia Randainensis (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Swertia Spaciosa (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Swertia Swertiopsis (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Swertia Swertopsis (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Swertia Thomsonii (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Swertia Tosaensis (Plant) Rel Props:Reference:

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Swertifrancheside

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Phytochemical Properties

Associated Connections 47

Plant Connections 47