S-Propyl-L-cysteine

PubChem CID: 101975

Connections displayed (default: 10).

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Compound Synonyms	L-Cysteine, S-propyl-, S-Propyl-L-cysteine, 1115-93-1, (2R)-2-amino-3-propylsulfanylpropanoic acid, (R)-2-Amino-3-(propylthio)propanoic acid, Propylcysteine #, Alanine, 3-(propylthio)-, L-, s-propyl cysteine, S-(n-Propyl)-L-cysteine, SCHEMBL1157633, DTXSID30912187, CHEBI:192026, WAAGBMYUYFBZIW-YFKPBYRVSA-N, GLXC-02050, EX-A9347, DB-290158, (2R)-2-amino-3-propylsulanylpropanoic acid
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	88.6
Hydrogen Bond Donor Count	2.0
Pfizer 3 75 Rule	False
Np Classifier Class	Aminoacids, Dipeptides
Deep Smiles	CCCSC[C@@H]C=O)O))N
Heavy Atom Count	10.0
Classyfire Class	Carboxylic acids and derivatives
Classyfire Subclass	Amino acids, peptides, and analogues
Isotope Atom Count	0.0
Molecular Complexity	108.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	1.0
Iupac Name	(2R)-2-amino-3-propylsulfanylpropanoic acid
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organic acids and derivatives
Xlogp	-1.8
Gsk 4 400 Rule	True
Molecular Formula	C6H13NO2S
Prediction Swissadme	0.0
Inchi Key	WAAGBMYUYFBZIW-YFKPBYRVSA-N
Silicos It Class	Soluble
Fcsp3	0.8333333333333334
Logs	-1.6
Rotatable Bond Count	5.0
Logd	0.735
Synonyms	s-propyl-l-cysteine
Esol Class	Highly soluble
Functional Groups	CC(=O)O, CN, CSC
Compound Name	S-Propyl-L-cysteine
Prediction Hob Swissadme	0.0
Exact Mass	163.067
Formal Charge	0.0
Monoisotopic Mass	163.067
Hydrogen Bond Acceptor Count	4.0
Molecular Weight	163.24
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	0.6244996
Inchi	InChI=1S/C6H13NO2S/c1-2-3-10-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
Smiles	CCCSC[C@@H](C(=O)O)N
Nring	0.0
Np Classifier Biosynthetic Pathway	Amino acids and Peptides
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Small peptides

1. Outgoing r'ship FOUND_IN to/from Abelmoschus Moschatus (Plant) Rel Props:Reference:
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8. Outgoing r'ship FOUND_IN to/from Allium Carolinianum (Plant) Rel Props:Reference:
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55. Outgoing r'ship FOUND_IN to/from Berberis Integerrima (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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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 Cepa Alba (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Corallium Rubrum (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Coriandrum Sativum (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Cyclosorus Parasiticus (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Dictamnus Angustifolius (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Echinopsis Latifolius (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Echium Rubrum (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Elephantopus Angustifolius (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
94. Outgoing r'ship FOUND_IN to/from Elephantopus Carolinianus (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Elephantopus Hirtiflorus (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Elephantopus Mollis (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Elephantopus Scaber (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Herbertus Aduncus (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Herbertus Sakuraii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
100. Outgoing r'ship FOUND_IN to/from Isoplexis Chalcantha (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Isoplexis Sceptrum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
102. Outgoing r'ship FOUND_IN to/from Lathyrus Latifolius (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Lepidium Sativum (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Leptochilus Decurrens (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Libocedrus Decurrens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
106. Outgoing r'ship FOUND_IN to/from Libocedrus Plumosa (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Lilium Rubrum (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Lindera Megaphylla (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Loranthus Falcatus (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Loranthus Longiflorus (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Loranthus Parasiticus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
112. Outgoing r'ship FOUND_IN to/from Lupinus Angustifolius (Plant) Rel Props:Reference:
113. Outgoing r'ship FOUND_IN to/from Ochna Integerrima (Plant) Rel Props:Reference:
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117. Outgoing r'ship FOUND_IN to/from Pisum Sativum (Plant) Rel Props:Reference:
118. Outgoing r'ship FOUND_IN to/from Ribes Rubrum (Plant) Rel Props:Reference:
119. Outgoing r'ship FOUND_IN to/from Sarcocephalus Latifolius (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
120. Outgoing r'ship FOUND_IN to/from Senecio Latifolius (Plant) Rel Props:Reference:
121. Outgoing r'ship FOUND_IN to/from Solidago Decurrens (Plant) Rel Props:Reference:
122. Outgoing r'ship FOUND_IN to/from Triticum Sativum (Plant) Rel Props:Reference:
123. Outgoing r'ship FOUND_IN to/from Viguiera Decurrens (Plant) Rel Props:Reference:

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S-Propyl-L-cysteine

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Phytochemical Properties

Associated Connections 123

Plant Connections 123