Methyl trans-3-Hydroxycinnamate

PubChem CID: 5352910

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Compound Synonyms	66417-46-7, Methyl trans-3-Hydroxycinnamate, 3-Hydroxycinnamic acid methyl ester, 3943-95-1, 2-Propenoic acid, 3-(3-hydroxyphenyl)-, methyl ester, (2E)-, Methyl 3-(3-hydroxyphenyl)acrylate, methyl (E)-3-(3-hydroxyphenyl)prop-2-enoate, trans-3-(3-hydroxyphenyl)acrylic acid methyl ester, 2-Propenoic acid, 3-(3-hydroxyphenyl)-, methyl ester, methyl 3-(3-hydroxyphenyl)prop-2-enoate, methyl (2E)-3-(3-hydroxyphenyl)prop-2-enoate, Cinnamic acid, m-hydroxy-, methyl ester, Methyl (E)-3-(3-hydroxyphenyl)acrylate, Methyl 3-(3-hydroxyphenyl)-2-propenoate, MFCD09259949, m-coumaric methyl ester, Methyl m-hydroxycinnamate, methyl 3-hydroxycinnamate, methyl trans-3-coumarate, methyl (E)-3-hydroxycinnamate, CHEMBL151178, SCHEMBL2631340, CHEBI:131393, m-Hydroxycinnamic acid, methyl ester, AKOS006331414, Methyl ester of m-hydroxycinnamic acid, (E)-methyl 3-(3-hydroxyphenyl)acrylate, AS-70747, FM158183, methyl (2E)-3-(3-hydroxyphenyl)acrylate, DB-230824, CS-0313933, A11407, (E)-3-(3-hydroxyphenyl)-acrylic acid methyl ester
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1.0
Heavy Atom Count	13.0
Isotope Atom Count	0.0
Molecular Complexity	198.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Uniprot Id	P47199
Iupac Name	methyl (E)-3-(3-hydroxyphenyl)prop-2-enoate
Prediction Hob	1.0
Xlogp	2.1
Molecular Formula	C10H10O3
Prediction Swissadme	0.0
Inchi Key	PKALKWFZXXGNJD-AATRIKPKSA-N
Fcsp3	0.1
Logs	-2.139
Rotatable Bond Count	3.0
Logd	2.234
Compound Name	Methyl trans-3-Hydroxycinnamate
Prediction Hob Swissadme	0.0
Exact Mass	178.063
Formal Charge	0.0
Monoisotopic Mass	178.063
Hydrogen Bond Acceptor Count	3.0
Molecular Weight	178.18
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	1.0
Esol	-2.4238978615384617
Inchi	InChI=1S/C10H10O3/c1-13-10(12)6-5-8-3-2-4-9(11)7-8/h2-7,11H,1H3/b6-5+
Smiles	COC(=O)/C=C/C1=CC(=CC=C1)O
Nring	1.0
Defined Bond Stereocenter Count	1.0

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65. Outgoing r'ship FOUND_IN to/from Turnera Angustifolia (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Typha Angustata (Plant) Rel Props:Reference:
67. Outgoing r'ship FOUND_IN to/from Typha Angustifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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71. Outgoing r'ship FOUND_IN to/from Typha Latifolia (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Typha Orientalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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77. Outgoing r'ship FOUND_IN to/from Zamia Angustifolia (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Zosima Orientalis (Plant) Rel Props:Reference:

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Methyl trans-3-Hydroxycinnamate

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Phytochemical Properties

Associated Connections 78

Plant Connections 78