9-Hydroxynonanoic acid

PubChem CID: 138052

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Compound Synonyms	9-Hydroxynonanoic acid, 3788-56-5, 8-Carboxyoctanol, Nonanoic acid, 9-hydroxy-, 9-hydroxy pelargonic acid, 9-Hydroxy-nonanoic acid, 9-hydroxypelargonic acid, UNII-HV672SU12G, HV672SU12G, omega-hydroxynonanoic acid, MFCD00792445, CHEBI:79121, DTXSID50191316, 9-Hydroxynonanoic Acid, 9-Hydroxypelargonic Acid, , 9-Hydroxypelargonate, Omega-hydroxynonanoate, 9-Hydroxy pelargonate, SCHEMBL464978, DTXCID60113807, AFZMICRBFKZNIH-UHFFFAOYSA-N, 9-hydroxynonanoic acid, AldrichCPR, LMFA01050028, AKOS006228162, CS-W010763, DS-17193, SY022017, DB-049208, Q27148182
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	12.0
Description	9-hydroxynonanoic acid, also known as 9-hydroxy pelargonate or omega-hydroxynonanoate, belongs to medium-chain hydroxy acids and derivatives class of compounds. Those are hydroxy acids with a 6 to 12 carbon atoms long side chain. Thus, 9-hydroxynonanoic acid is considered to be a fatty acid lipid molecule. 9-hydroxynonanoic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). 9-hydroxynonanoic acid can be synthesized from nonanoic acid. 9-hydroxynonanoic acid is also a parent compound for other transformation products, including but not limited to, oscr#10, (3R)-3,9-dihydroxynonanoic acid, and icos#10. 9-hydroxynonanoic acid can be found in potato, which makes 9-hydroxynonanoic acid a potential biomarker for the consumption of this food product.
Isotope Atom Count	0.0
Molecular Complexity	112.0
Database Name	cmaup_ingredients;fooddb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	9-hydroxynonanoic acid
Prediction Hob	1.0
Xlogp	0.4
Molecular Formula	C9H18O3
Prediction Swissadme	1.0
Inchi Key	AFZMICRBFKZNIH-UHFFFAOYSA-N
Fcsp3	0.8888888888888888
Logs	-1.238
Rotatable Bond Count	8.0
Logd	0.35
Synonyms	9-Hydroxy-nonanoic acid, 9-hydroxynonanoic Acid
Compound Name	9-Hydroxynonanoic acid
Prediction Hob Swissadme	1.0
Exact Mass	174.126
Formal Charge	0.0
Monoisotopic Mass	174.126
Hydrogen Bond Acceptor Count	3.0
Molecular Weight	174.24
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	0.0
Esol	-0.6631879999999999
Inchi	InChI=1S/C9H18O3/c10-8-6-4-2-1-3-5-7-9(11)12/h10H,1-8H2,(H,11,12)
Smiles	C(CCCCO)CCCC(=O)O
Nring	0.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Angelica Sinensis (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Aquilaria Sinensis (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Argyreia Speciosa (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Asclepias Speciosa (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Bretschneidera Sinensis (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Camellia Sinensis (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Cephalotaxus Sinensis (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Chaenomeles Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
9. Outgoing r'ship FOUND_IN to/from Chaenomeles Speciosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
10. Outgoing r'ship FOUND_IN to/from Citrus Sinensis (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Cordia Sinensis (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Cordyceps Sinensis (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Cryptolepis Sinensis (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Diphylleia Sinensis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Dolichos Sinensis (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Erythrina Speciosa (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Garcinia Speciosa (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Gleditsia Sinensis (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Guettarda Speciosa (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Hymenocallis Speciosa (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Incarvillea Sinensis (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Juglans Sinensis (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Lagerstroemia Speciosa (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Macaranga Sinensis (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Miliusa Sinensis (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Miscanthus Sinensis (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Mitragyna Speciosa (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Neottia Sinensis (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Nyssa Sinensis (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Orobanche Speciosa (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Prunus Speciosa (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Pseudotsuga Sinensis (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Saccharum Sinensis (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Scopolia Sinensis (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Selaginella Sinensis (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Sesbania Speciosa (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Solanum Tuberosum (Plant) Rel Props:Source_db:fooddb_chem_all
38. Outgoing r'ship FOUND_IN to/from Spiranthes Sinensis (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Telekia Speciosa (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Tinospora Sinensis (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Toona Sinensis (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Uncaria Sinensis (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Ursinia Speciosa (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Wisteria Sinensis (Plant) Rel Props:Reference:

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9-Hydroxynonanoic acid

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Phytochemical Properties

Associated Connections 44

Plant Connections 44