S-1-Propenyl-L-cysteine

PubChem CID: 11989381

Connections displayed (default: 10).

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Compound Synonyms	S-1-Propenyl-L-cysteine, 52438-09-2, S-Propenylcysteine, (E)-S-(Prop-1-en-1-yl)-L-cysteine, (2R)-2-amino-3-[(E)-prop-1-enyl]sulfanylpropanoic acid, trans-(+)-S-1-Propenyl-L-cystein, AKOS040737003, DA-77622, MS-22893, HY-111827, CS-0092922, G14638
Topological Polar Surface Area	88.6
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	10.0
Description	S-propenylcysteine is a member of the class of compounds known as L-cysteine-s-conjugates. L-cysteine-s-conjugates are compounds containing L-cysteine where the thio-group is conjugated. S-propenylcysteine is soluble (in water) and a moderately acidic compound (based on its pKa). S-propenylcysteine can be found in soft-necked garlic, which makes S-propenylcysteine a potential biomarker for the consumption of this food product.
Isotope Atom Count	0.0
Molecular Complexity	136.0
Database Name	cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	1.0
Iupac Name	(2R)-2-amino-3-[(E)-prop-1-enyl]sulfanylpropanoic acid
Prediction Hob	1.0
Class	Carboxylic acids and derivatives
Xlogp	-2.0
Superclass	Organic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Molecular Formula	C6H11NO2S
Prediction Swissadme	0.0
Inchi Key	HYGGRRPFVXHQQW-HRJJCQLASA-N
Fcsp3	0.5
Logs	-1.283
Rotatable Bond Count	4.0
Logd	0.201
Synonyms	S-1-Propenyl-L-cysteine
Compound Name	S-1-Propenyl-L-cysteine
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	161.051
Formal Charge	0.0
Monoisotopic Mass	161.051
Hydrogen Bond Acceptor Count	4.0
Molecular Weight	161.22
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	1.0
Molecular Framework	Aliphatic acyclic compounds
Esol	0.6780988
Inchi	InChI=1S/C6H11NO2S/c1-2-3-10-4-5(7)6(8)9/h2-3,5H,4,7H2,1H3,(H,8,9)/b3-2+/t5-/m0/s1
Smiles	C/C=C/SC[C@@H](C(=O)O)N
Nring	0.0
Defined Bond Stereocenter Count	1.0
Taxonomy Direct Parent	L-cysteine-S-conjugates

1. Outgoing r'ship FOUND_IN to/from Abelmoschus Moschatus (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Acacia Decurrens (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Acer Rubrum (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Allium Ampeloprasum (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Allium Angulosum (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Allium Ascalonicum (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Allium Azureum (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Allium Carolinianum (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Allium Cepa (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Allium Chinense (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Allium Consanguineum (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Allium Fistulosum (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Allium Hookeri (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Allium Humile (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Allium Macleanii (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Allium Macrostemon (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Allium Monspessulanum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Allium Neapolitanum (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Allium Nutans (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Allium Przewalskianum (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Allium Rhabdotum (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Allium Rosenorum (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Allium Sativum (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all
24. Outgoing r'ship FOUND_IN to/from Allium Schoenoprasum (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Allium Stipitatum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Allium Stracheyi (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Allium Tuberosum (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Allium Ursinum (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Allium Victorialis (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Allium Wallichii (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Aniba Duckei (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Aniba Megaphylla (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
33. Outgoing r'ship FOUND_IN to/from Aniba Parviflora (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Aniba Rosaeodora (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Aniba Santalodora (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Archangelica Decurrens (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Berberis Actinacantha (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Berberis Amurensis (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Berberis Aristata (Plant) Rel Props:Reference:
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41. Outgoing r'ship FOUND_IN to/from Berberis Baluchistanica (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Berberis Brandisiana (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Berberis Chitria (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Berberis Concinna (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Berberis Coriaria (Plant) Rel Props:Reference:
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47. Outgoing r'ship FOUND_IN to/from Berberis Darwinii (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Berberis Diaphana (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Berberis Dictyophylla (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Berberis Dubia (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Berberis Floribunda (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Berberis Fortunei (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Berberis Ichiana (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Berberis Insignis (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Berberis Integerrima (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
56. Outgoing r'ship FOUND_IN to/from Berberis Jaeschkeana (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Berberis Japonica (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Berberis Julianae (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Berberis Kawakamii (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Berberis Koreana (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Berberis Lambertii (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Berberis Laurina (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Berberis Lycium (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Berberis Nepalensis (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Berberis Oblonga (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Berberis Orthobotrys (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Berberis Pachyacantha (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Berberis Petiolaris (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Berberis Poiretii (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Berberis Potaninii (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Berberis Pseudumbellata (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Berberis Repens (Plant) Rel Props:Reference:
73. Outgoing r'ship FOUND_IN to/from Berberis Thunbergii (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Berberis Tinctoria (Plant) Rel Props:Reference:
75. Outgoing r'ship FOUND_IN to/from Berberis Tschonoskiana (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Berberis Ulcina (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Berberis Umbellata (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Berberis Valdiviana (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Berberis Virescens (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Berberis Vulgaris (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Berberis Wallichiana (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Berberis Wilsonae (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Berberis Zycium (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Calamus Latifolius (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Caus Latifolius (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Corallium Rubrum (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Coriandrum Sativum (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Cyclosorus Parasiticus (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Dictamnus Angustifolius (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Echinopsis Latifolius (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Echium Rubrum (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Elephantopus Angustifolius (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
93. Outgoing r'ship FOUND_IN to/from Elephantopus Carolinianus (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Elephantopus Hirtiflorus (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Elephantopus Mollis (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Elephantopus Scaber (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Herbertus Aduncus (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Herbertus Sakuraii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
99. Outgoing r'ship FOUND_IN to/from Isoplexis Chalcantha (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Isoplexis Sceptrum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
101. Outgoing r'ship FOUND_IN to/from Lathyrus Latifolius (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Lepidium Sativum (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Leptochilus Decurrens (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Libocedrus Decurrens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
105. Outgoing r'ship FOUND_IN to/from Libocedrus Plumosa (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Lilium Rubrum (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Lindera Megaphylla (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Loranthus Falcatus (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Loranthus Longiflorus (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Loranthus Parasiticus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
111. Outgoing r'ship FOUND_IN to/from Lupinus Angustifolius (Plant) Rel Props:Reference:
112. Outgoing r'ship FOUND_IN to/from Ochna Integerrima (Plant) Rel Props:Reference:
113. Outgoing r'ship FOUND_IN to/from Pareptochilus Decurrens (Plant) Rel Props:Reference:
114. Outgoing r'ship FOUND_IN to/from Phenax Angustifolius (Plant) Rel Props:Reference:
115. Outgoing r'ship FOUND_IN to/from Pistacia Integerrima (Plant) Rel Props:Reference:
116. Outgoing r'ship FOUND_IN to/from Pisum Sativum (Plant) Rel Props:Reference:
117. Outgoing r'ship FOUND_IN to/from Ribes Rubrum (Plant) Rel Props:Reference:
118. Outgoing r'ship FOUND_IN to/from Sarcocephalus Latifolius (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
119. Outgoing r'ship FOUND_IN to/from Senecio Latifolius (Plant) Rel Props:Reference:
120. Outgoing r'ship FOUND_IN to/from Solidago Decurrens (Plant) Rel Props:Reference:
121. Outgoing r'ship FOUND_IN to/from Triticum Sativum (Plant) Rel Props:Reference:
122. Outgoing r'ship FOUND_IN to/from Viguiera Decurrens (Plant) Rel Props:Reference:

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S-1-Propenyl-L-cysteine

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Phytochemical Properties

Associated Connections 122

Plant Connections 122