AG003PW6

20902-45-8 | D-Penicillamine Disulfide

AG003PW6

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CAS Number	20902-45-8
Catalog Number	AG003PW6(AGN-PC-0O7ORU)
Chemical Name	D-Penicillamine Disulfide
EC Number	244-107-2
IUPAC Name	(2S)-2-amino-3-[[(1S)-1-amino-1-carboxy-2-methylpropan-2-yl]disulfanyl]-3-methylbutanoic acid
InChI	InChI=1S/C10H20N2O4S2/c1-9(2,5(11)7(13)14)17-18-10(3,4)6(12)8(15)16/h5-6H,11-12H2,1-4H3,(H,13,14)(H,15,16)/t5-,6-/m0/s1
InChI Key	POYPKGFSZHXASD-WDSKDSINSA-N
MDL Number	MFCD00004264
Molecular Formula	C5H11NO2S
Molecular Weight	149.2113
SMILES	N[C@H](C(C)(S)C)C(O)=O
UNII	Q98FPI4N5P
Synonyms	penicillamine disulfide, penicillamine disulfide, (D)-isomer, D-Penicillamine disulfide, 3,3'-Dithiodi-D-valine, S,S'-Bi(D-penicillamine), 3,3,3,',3'-tetramethyl-D-cystine, UNII-Q98FPI4N5P, Penicillamine disulfide, Q98FPI4N5P, CHEBI:61196, 20902-45-8, NSC 87505, (2S,2'S)-3,3'-dithiobis(2-amino-3-methylbutanoic acid), (2S,2'S)-3,3'-dithiobis(2-amino-3-methylbutyric acid), (2S,2'S)-3,3'-disulfanediylbis(2-amino-3-methylbutanoic acid), Oxidized penicillamine, Oxidized D-penicillamine, Epitope ID:140793, Penicillamine disulfide D-form, SCHEMBL6501684, D-Penicillamine disulfide, 97%, ZINC1562120, EINECS 244-107-2, API0008400, 3,3 inverted exclamation marka-Dithiobis-D-valine, S,S inverted exclamation marka-Bi(D-penicillamine), UNII-2218J7AI50 component POYPKGFSZHXASD-WDSKDSINSA-N, 3,3 inverted exclamation marka-Dithiobis(2-amino-3-methylbutanoic acid), 3,3 inverted exclamation marka-Dithiobis(2-amino-3-methylbutyric acid), Penicillamine disulfide, European Pharmacopoeia (EP) Reference Standard, Penicillamine disulfide, United States Pharmacopeia (USP) Reference Standard, penicillamine disulphide, CID9882671, CS-T-38833,

Complexity	302
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	296.086g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	296.4g/mol
Monoisotopic Mass	296.086g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	177A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-5

GHS Hazard and Precautionary Statements

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

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