AG00I5DW

28860-95-9 | 3,3,3-trideuterio-2-[dideuterio-(3,4-dihydroxyphenyl)methyl]-2-hydrazinylpropanoic acid

AG00I5DW

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CAS Number	28860-95-9
Catalog Number	AG00I5DW(AGN-PC-07A1TF)
Chemical Name	3,3,3-trideuterio-2-[dideuterio-(3,4-dihydroxyphenyl)methyl]-2-hydrazinylpropanoic acid
EC Number	249-271-9
IUPAC Name	(2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid
InChI	InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1
InChI Key	TZFNLOMSOLWIDK-JTQLQIEISA-N
MDL Number	MFCD00889211
Molecular Formula	C10H14N2O4
Molecular Weight	226.2292
NSC Number	751137
SMILES	OC=1C=C(C=CC1O)C[C@](C(=O)O)(C)NN
UNII	KR87B45RGH
Synonyms	Carbidopa, Carbidopa, (R)-Isomer, Carbidopa, (S)-Isomer, Lodosin, Lodosyn, Methyldopahydrazine, MK 485, MK 486, MK-485, MK-486, MK485, MK486, carbidopa, 28860-95-9, Lodosyn, (S)-(-)-carbidopa, N-Aminomethyldopa, alpha-Methyldopahydrazine, Carbidopa anhydrous, Carbidopum, L-alpha-Methyldopahydrazine, Carbidopum [INN-Latin], S-(-)-Carbidopa, Carbidopa (anhydrous), (S)-carbidopa, Hadrazino-alpha-methyldopa, Lodosin, C-DOPA, L-3-(3,4-Dihydroxyphenyl)-2-methyl-2-hydrazinopropionic acid, UNII-KR87B45RGH, MK-486, CCRIS 5093, (-)-L-alpha-Hydrazino-3,4-dihydroxy-alpha-methylhydrocinnamic acid, S(-)-CARBIDOPA, EINECS 249-271-9, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazino-2-methylpropanoic acid, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid, 38821-49-7, MK 486, KR87B45RGH, CHEBI:39585, alpha-Hydrazino-alpha-methyl-beta-(3,4-dihydroxyphenyl)propionic acid, (alphaS)-alpha-hydrazino-3,4-dihydroxy-alpha-methylbenzenepropanoic acid, L-alpha-Methyl-alpha-hydrazino-beta-(3,4-dihydroxyphenylpropionic acid, L-alpha-Methyl-beta-(3,4-dihydroxyphenyl)-alpha-hydrazinopropionic acid, MFCD00069231, NCGC00024596-05, AK326162, (S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid, Carbidopa, (S)-Isomer, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazino-2-methyl-propanoic acid, Benzenepropanoic acid, alpha-hydrazino-3,4-dihydroxy-alpha-methyl-, (S)-, HYDROCINNAMIC ACID, alpha-HYDRAZINO-3,4-DIHYDROXY-alpha-METHYL-, L-, Carbidopa [INN], SMR000058235, SR-01000597655, ND0611, KINSON, Tocris-0455, AC1L1RFR, AC1Q5QGW, C-126, DSSTox_CID_2735, DSSTox_RID_76707, DSSTox_GSID_22735, Lopac0_000382, SCHEMBL35084, MLS000069628, MLS002207014, (S)-3-(3,4-Dihydroxyphenyl)-2-hydrazino-2-methylpropanoic acid, GTPL5159, CHEMBL1201236, DTXSID4022735, AOB5343, TZFNLOMSOLWIDK-JTQLQIEISA-N, HMS2089B12, HMS3266A20, HMS3655G20, HMS3675M13, HMS3713L10, HY-B0311, KS-00000Y5G, Tox21_110910, BDBM50418773, BG0127, GP7031, NSC751137, S-(-)-alpha-Hydrazino-3,4-dihydroxy-2-methylbenzenepropanoic acid, s1891, SBB000659, ZINC19168887, AKOS015969657, KINSON, 3-(3,4-DIHYDROXY-PHENYL)-2-HYDRAZINO-2-METHYL-PROPIONIC ACID, AC-1676, API0000921, CCG-204476, CS-2351, DB00190, NSC-751137, RDL0000336, (+)-2-(3,4-Dihydroxybenzyl)-2-hydrazinopropionic acid monohydrate, MLS-0072919, SMP1_000057, NCGC00024596-01, NCGC00024596-03, NCGC00024596-06, NCGC00024596-07, NCGC00024596-08, AN-14724, AS-16862, LS-77199, SC-12185, ST055523, MLS-0072919.P013, AB2000353, CAS-28860-95-9, EU-0100382, FT-0602918, SW199080-2, 60C959, M-1664, AB00441332-05, AB00441332-06, AB00441332_07, AB00441332_08, SR-01000597655-1, SR-01000597655-3, SR-01000597655-5, SR-01000597655-9, BRD-K78712176-001-07-5, Benzenepropanoic acid, a-hydrazino-3,4-dihydroxy-a-methyl-, UNII-555UP07D5N component TZFNLOMSOLWIDK-JTQLQIEISA-N, 3-(3,4-dihydroxy-phenyl)-2-hydrazino-2-methyl-propionic acid, (S)-?-Hydrazino-?-methyl-?-(3,4-dihydroxyphenyl)propionic acid, (S)-3-(3,4-Dihydroxyphenyl)-2-hydrazino-2-methylpropionic Acid, (2S)-3-(3,4-DIHYDROXYPHENYL)-2-HYDRAZINYL-2-METHYL-PROPANOIC ACID, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazino-2-methylpropionic acid monohydrate, 3,3,3-trideuterio-2-[dideuterio-(3,4-dihydroxyphenyl)methyl]-2-hydrazinylpropanoic acid, Carbidopa hydrate, Atamet, Carbidopa Monohydrate, Duodopa, Stalevo, Methyldopahydrazine, Carbidopa-1-wasser, Lodosyn, Carbidopa, Lodosyn (TN), (S)-carbidopahydrate, carbidopum monohydricum, Carbidopa, (R)-Isomer, UNII-MNX7R8C5VO, Carbidopa [USAN:INN:BAN], D0P7JZ, (S)-(-)-carbidopa hydrate, C10H14N2O4.H2O, MK-485, C10H14N2O4, MK485, MK486, Carbidopa, Entacapone, & Levodopa, CID34359, MK 485, C10-H14-N2-O4, Carbidopa [USAN:USP:INN:BAN:JAN], CS-O-01054, C10-H14-N2-O4.H2-O, B1904, C2450, A10181, D002230, (-)-L-alpha-Hydrazino-3,4-dihydroxy-alpha-methylhydrocinnamic acid monohydrate, 3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methyl-propanoic acid, S(-)-alpha-Hydrazino-3,4-dihydroxy-alpha-methylhydrocinnamic acid monohydrate, Benzenepropanoic acid, ?-hydrazino-3,4-dihydroxy-?-methyl-, (?S)-, Benzenepropanoic acid, alpha-hydrazino-3,4-dihydroxy-alpha-methyl-, monohydrate, (S)-, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid hydrate, Hydrocinnamic acid, .alpha.-hydrazino-3,4-dihydroxy-.alpha.-methyl-, L-, L-alpha-(3,4-dihydroxybenzyl)-alpha-hydrazinopropionic acid monohydrate, (-)-L-alpha-hydrazino-3,4-dihydroxy-alpha-methylhydro-cinnamic acid monohydrate, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid monohydrate, (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid-water (1/1), (alpha S)-alpha-Hydrazinyl-3,4-dihydroxy-alpha-methylbenzenepropanoic acid hydrate (1:1), (alphaS)-alpha-hydrazino-3,4-dihydroxy-alpha-methylbenzenepropanoic acid monohydrate, (S)-alpha-Hydrazino-3,4-dihydroxy-alpha-methyl-benzenepropanoic acid monohydrate, Benzenepropanoic acid, .alpha.-hydrazino-3,4-dihydroxy-.alpha.-methyl-, (S)-, Benzenepropanoic acid, .alpha.-hydrazino-3,4-dihydroxy-.alpha.-methyl-, monohydrate, (S)-, Benzenepropanoic acid, alpha-hydrazino-3,4-dihydroxy-alpha-methyl-, monohydrate, (S), Hydrocinnamic acid, (-)-L-alpha-hydrazino-3,4-dihydroxy-alpha-methyl-, monohydrate, HMD,

Complexity	261
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	226.095g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	226.232g/mol
Monoisotopic Mass	226.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	116A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number