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| CAS Number | 52-66-4 |
| Catalog Number | AG00DENL(AGN-PC-0WAJ34) |
| Chemical Name | DL-Penicillamine |
| IUPAC Name | 2-amino-3-methyl-3-sulfanylbutanoic acid |
| InChI | InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8) |
| InChI Key | VVNCNSJFMMFHPL-UHFFFAOYSA-N |
| MDL Number | MFCD00004856 |
| Molecular Formula | C5H11NO2S |
| Molecular Weight | 149.2113 |
| SMILES | CC(C)(S)C(N)C(O)=O |
| Synonyms | beta,beta Dimethylcysteine,
beta,beta-Dimethylcysteine,
Copper Penicillaminate,
Cuprenil,
Cuprimine,
D 3 Mercaptovaline,
D Penicillamine,
D-3-Mercaptovaline,
D-Penicillamine,
Dimethylcysteine,
Mercaptovaline,
Metalcaptase,
Penicillaminate, Copper,
Penicillamine,
DL-Penicillamine,
52-66-4,
penicillamine,
2-Amino-3-mercapto-3-methylbutanoic acid,
3,3-Dimethyl-DL-cysteine,
3-Sulfanylvaline,
DL-beta-Mercaptovaline,
beta-Mercaptovaline,
D,L-Penicillamine,
DL-3-Mercaptovaline,
(+-)-Penicillamine,
3-Mercaptovaline,
2-amino-3-methyl-3-sulfanylbutanoic acid,
2-Amino-3-mercapto-3-methylbutyric acid,
DL-Valine, 3-mercapto-,
Cysteine, 3,3-dimethyl-,
MFCD00004856,
dl-beta,beta-Dimethylcysteine,
Valine, 3-mercapto-, DL-,
L-Pen-OH,
Valine, 3-mercapto-,
EINECS 200-147-2,
NSC 22880,
NSC 44656,
NSC241261,
BRN 2039817,
2-amino-3-methyl-3-sulfanyl-butanoic acid,
CHEBI:50868,
VVNCNSJFMMFHPL-UHFFFAOYSA-N,
2-Amino-3-mercapto-3-methyl-butyric acid,
L-Valine, 3-mercapto-,
DL-.beta.-Mercaptovaline,
DL-2-Amino-3-mercapto-3-methylbutanoic acid,
Penicilllamine,
D-Penicyllamine,
valine, 3-mercapto,
3,3-Dimethyl-D-cysteine,
4-04-00-03228 (Beilstein Handbook Reference),
NSC-241261,
l-3-Mercaptovaline,
3-Sulfanylvaline #,
D-Penicillamine-HCl,
3,3-dimethylcysteine,
3-Mercapto-DL-valine,
beta-Mercapto-DL-valine,
AC1L1ITK,
AC1Q1NPC,
beta-Mercapto-DL -valine,
ACMC-1AMA8,
ACMC-209l0v,
Penicillamine, (+/-)-,
NCIOpen2_000958,
SCHEMBL57527,
3,3-Dimethyl-DL -cysteine,
MLS006011473,
CHEMBL13239,
SPECTRUM1500464,
ACMC-20999d,
AC1Q5S31,
DTXSID7044687,
CTK3J0362,
HMS500P16,
HMS1920F10,
HMS2094G19,
HMS3259K09,
HMS3714E05,
BCP24237,
KS-000013DK,
NSC22880,
NSC44656,
NSC81988,
ANW-31514,
BBL013214,
CCG-40247,
NSC-22880,
NSC-44656,
NSC-81988,
STK249738,
AKOS000121093,
CS-W018173,
MCULE-4184299411,
NC00476,
RTR-018670,
NCGC00018283-03,
AK170110,
AN-10865,
AN-48523,
CPD000059161,
NCI60_001936,
SAM002264642,
SC-11163,
SMR000059161,
SY046568,
SBI-0051475.P003,
2-azanyl-3-methyl-3-sulfanyl-butanoic acid,
DB-021813,
LS-161322,
ST2416357,
FT-0625502,
P0025,
X3459,
EN300-95022,
MFCD00064302 (97%),
3809-EP2272972A1,
3809-EP2272973A1,
3809-EP2277872A1,
A11889,
P-1290,
AB00052067_10,
AB00052067_11,
AB00375988-03,
(2RS)-2-amino-3-methyl-3-sulfanyl-butanoic acid,
SR-05000001692,
SR-05000001692-1,
I14-19085,
L-(+)-2-Amino-3-mercapto-3-methylbutanoic acid |A,|A-Dimethyl-L-cysteine,
DL-2- degrees +/->>u-3-UI>>u-3-(1/4)x>>u paragraph sign inverted exclamation markEa,
87457-85-0,
L-Penicillamine,
D-Penicillamine,
Atheroline,
Penicillamin,
Dimethylcysteine,
beta-Thiovaline,
D-Penicilamine,
D-Mercaptovaline,
D-Penamine,
Penicillamine DL-,
3-Mercapto-L-valine,
Penicillamine L-form,
Valine, DL-,
3-sulfanyl-L-valine,
DL-beta-mercaptovalin,
D-Valine, 3-mercapto-,
Penicillamina [DCIT],
D-(-)-Penicillamine,
L-(+)-Penicillamine,
C5H11NO2S,
beta,beta-Dimethylcysteine,
UNII-2XOP7Y1H98,
3,3-Dimethyl-L-cysteine,
VALINE, L-,
Penicilamina [INN-Spanish],
Penicillaminum [INN-Latin],
Valine, 3-mercapto-, L-,
2XOP7Y1H98,
CID4727,
C5-H11-N-O2-S,
AR-1F5219,
1113-41-3,
52-67-5,
(R)-2-Amino-3-mercapto-3-methylbutanoic acid,
(2R)-2-amino-3-methyl-3-sulfanylbutanoic acid,
DMC,
|A,|A- paragraph signthorn(1/4)x>>u-DL- degrees eex degrees +/-Ea,
25526-04-9,
53760-56-8,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.208g/mol |
| Monoisotopic Mass | 149.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.8 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319 |
| Packing Group | |
| Precautionary statements | P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
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| Test: | Result: |

