4-Pentenal

PubChem CID: 16418

Connections displayed (default: 10).

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Compound Synonyms	4-PENTENAL, pent-4-enal, 2100-17-6, BRN 1734369, EINECS 218-265-8, 71K1W8950B, 4-PENT-4-ENAL, 4-PENTENAL [FHFI], AI3-24690, 4-PENT-4-EN-1-AL, DTXSID1062178, FEMA NO. 4262, Pent-4-en-1-al, 4-penten-1-al, MFCD00151841, 4-Pentenal, AldrichCPR, DTXCID7036408, UNII-71K1W8950B, QUMSUJWRUHPEEJ-UHFFFAOYSA-, CHEBI:173318, CAA10017, AKOS009157546, AS-56254, NS00021844, EN300-128781, Q27265961, InChI=1/C5H8O/c1-2-3-4-5-6/h2,5H,1,3-4H2
Ghose Rule	False
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0.0
Pfizer 3 75 Rule	False
Np Classifier Class	Fatty aldehydes
Deep Smiles	C=CCCC=O
Heavy Atom Count	6.0
Classyfire Class	Organooxygen compounds
Classyfire Subclass	Carbonyl compounds
Isotope Atom Count	0.0
Molecular Complexity	47.9
Database Name	cmaup_ingredients;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	pent-4-enal
Prediction Hob	1.0
Class	Organooxygen compounds
Veber Rule	True
Classyfire Superclass	Organic oxygen compounds
Xlogp	0.8
Superclass	Organic oxygen compounds
Subclass	Carbonyl compounds
Gsk 4 400 Rule	True
Molecular Formula	C5H8O
Prediction Swissadme	0.0
Inchi Key	QUMSUJWRUHPEEJ-UHFFFAOYSA-N
Silicos It Class	Soluble
Fcsp3	0.4
Logs	-0.387
Rotatable Bond Count	3.0
Logd	0.855
Synonyms	Pent-4-enal, 4-pentenal
Esol Class	Very soluble
Functional Groups	C=CC, CC=O
Compound Name	4-Pentenal
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	84.0575
Formal Charge	0.0
Monoisotopic Mass	84.0575
Hydrogen Bond Acceptor Count	1.0
Molecular Weight	84.12
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	0.0
Molecular Framework	Aliphatic acyclic compounds
Lipinski Rule Of 5	True
Esol	-0.6486315999999999
Inchi	InChI=1S/C5H8O/c1-2-3-4-5-6/h2,5H,1,3-4H2
Smiles	C=CCCC=O
Nring	0.0
Np Classifier Biosynthetic Pathway	Fatty acids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Taxonomy Direct Parent	Alpha-hydrogen aldehydes
Np Classifier Superclass	Fatty acyls

1. Outgoing r'ship FOUND_IN to/from Allium Wallichii (Plant) Rel Props:Reference:https://doi.org/10.1016/s0167-4501(06)80207-4
2. Outgoing r'ship FOUND_IN to/from Artemisia Abrotanum (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Artemisia Absinthium (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Artemisia Afra (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Artemisia Annua (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Artemisia Anomala (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Artemisia Apiacea (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Artemisia Arborescens (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Artemisia Arbuscula (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Artemisia Argentea (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Artemisia Argyi (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Artemisia Assoana (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Artemisia Aucheri (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Artemisia Austriaca (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Artemisia Biennis (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Artemisia Bigelovii (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Artemisia Brevifolia (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Artemisia Caerulescens (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Artemisia Campestris (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Artemisia Canariensis (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Artemisia Capillari (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Artemisia Capillaries (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Artemisia Capillaris (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
24. Outgoing r'ship FOUND_IN to/from Artemisia Carvifolia (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Artemisia Caucasica (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Artemisia Chinensis (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Artemisia Cina (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Artemisia Coerulescens (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Artemisia Dentata (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Artemisia Desertorum (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Artemisia Dracunculus (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Artemisia Gilvescens (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Artemisia Giraldii (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Artemisia Glabella (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Artemisia Gmelini (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Artemisia Gmelinii (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Artemisia Halodendron (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Artemisia Hanseniana (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Artemisia Incanescens (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Artemisia Indica (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Artemisia Iwayomogi (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Artemisia Jacutica (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Artemisia Japonica (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Artemisia Judaica (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Artemisia Juncea (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Artemisia Klotzchiana (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Artemisia Kurramensis (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Artemisia Laciniata (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Artemisia Lactiflora (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Artemisia Ludoviciana (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Artemisia Macrocephala (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Artemisia Maderaspatana (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Artemisia Maritima (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Artemisia Mesatlantica (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Artemisia Mexicana (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Artemisia Minor (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Artemisia Mongolica (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Artemisia Monogyna (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Artemisia Monosperma (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Artemisia Montana (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Artemisia Moorcroftiana (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Artemisia Myriantha (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Artemisia Niirica (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Artemisia Nilagirica (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Artemisia Oranensis (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Artemisia Pallens (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Artemisia Parviflora (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Artemisia Pectinata (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Artemisia Pedemontana (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Artemisia Persica (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Artemisia Porrecta (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Artemisia Princeps (Plant) Rel Props:Reference:
73. Outgoing r'ship FOUND_IN to/from Artemisia Rehan (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Artemisia Roxbugiana (Plant) Rel Props:Reference:
75. Outgoing r'ship FOUND_IN to/from Artemisia Roxburghiana (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Artemisia Rubripes (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Artemisia Rupestris (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Artemisia Rutifolia (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Artemisia Salsoloides (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Artemisia Schimperi (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Artemisia Schmidtiana (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Artemisia Schrenkiana (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Artemisia Scoparia (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Artemisia Sieversiana (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Artemisia Siversiana (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Artemisia Stracheyi (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Artemisia Sylvatica (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Artemisia Taurica (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Artemisia Tournefortiana (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Artemisia Tridentata (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Artemisia Umbelliformis (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Artemisia Urghiana (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Artemisia Vachanica (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Artemisia Vestita (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Artemisia Vulgaris (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Artemisia Wallichiana (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Fragaria Ananassa (Plant) Rel Props:Source_db:npass_chem_all
98. Outgoing r'ship FOUND_IN to/from Fragaria Chiloensis (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Fragaria Indica (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Fragaria Nilgherrensis (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Fragaria Nubicola (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Fragaria Vesca (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Fragaria X (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Tetraria Capillaris (Plant) Rel Props:Reference:

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4-Pentenal

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Phytochemical Properties

Associated Connections 104

Plant Connections 104