epam / ketcher

Web-based molecule sketcher
https://lifescience.opensource.epam.com/ketcher/demo.html
Apache License 2.0
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Change names of monomers #5323

Closed ljubica-milovic closed 1 month ago

ljubica-milovic commented 2 months ago

Peptides

Symbol Old name New name
3Pal 3-(2-pyridyl)-alanine 3-(3-pyridyl)-alanine
D-2Nal D-3-(2-naphtyl)-alanine D-3-(2-naphthyl)-alanine
NMebAl 3-(methylamino)propanoic acid N-methyl-beta-alanine
DALys 6-amino-2-hydroxyhexanoic acid (2S)-6-amino-2-hydroxyhexanoic acid
aMeTyr L-metyrosine alpha-methyl-tyrosine
D-OAla D-lactic acid D-Lactic acid

Phosphates

Symbol Old name New name
m2nen (Dimethylaminoethyl)amino N1,N1-dimethylethane-1,2-diamine
mepo2 Methylenephosphonate Hydroxymethylphosphonic acid
msp Methylthiophosphonate Methylphosphonothioic acid
P- (old symbol: naP) Sodium Phospate Dihydrogen phosphate
sP- (old symbol: nasP) Sodium Phosphothiotate Dihydrogen phosphorothioate
nen (Aminoethyl)amino Ethylenediamine
oxy Oxy (ether) Oxy

Bases

Symbol Old name New name
s6puri 6-Thiopurine 6-Mercaptopurine
brviny 5-(2-Bromovinyl)uracil (E)-5-(2-bromovinyl)uracil
d4U 4-Deoxouracil 2-hydroxypyrimidine
DBCOnC 5-DBCO-U (ethylene carbamoyl hexylamino linker) 5-DBCO-U
mnm5U 5-[(Methylamino)methyl]uridine 5-[(methylamino)methyl]uracil
thiz5U 5-Thiazoleuridine 5-Thiazoleuracil
pr56U 5,6-Propylene uracil 6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,4(3H,5H)-dione
h456U 4,5,6-trihydrouracil tetrahydro-4-hydroxy-1H-pyrimidin-2-one
h456UR (R)-4,5,6-trihydrouracil (4R)-tetrahydro-4-hydroxy-1H-pyrimidin-2-one
m1Yra 1-Methyl-pseudouracil N1-methyl-pseudouracil
cnes4T 4-Cyanoethylthiothymidine 4-Cyanoethylthiothymine
allyl9 9-Allylguanine N9-allyl-8-oxoguanine
m1G 1-Methylguanine N1-methylguanine
m22G 2,2-Dimethylguanine N2,N2-dimethylguanine
m2G 2-Methylguanine N2-methylguanine
m6G 6-Methylguanine 6-O-methylguanine
m7G 7-Methylguanine N7-methylguanine
m7h8G 7-Methyl 8-dihydroguanine N7-methyl-8-dihydroguanine
5meC 5-methyl-cytidine 5-methylcytosine
ac4C 4-Acetylcytosine N4-acetylcytosine
gclamp G-clamp (9-(aminoetoxy)phenoxazine) G-clamp
ggclam G-clamp (9-(guanylethoxy)phonoxazine guanidino-G-clamp
oh4C 4-N-Hydroxycytosine 4N-Hydroxycytosine
az8A Azidoadenine 8-azidoadenine
baA N-benzyl-adenine N6-benzyladenine
cmpA N-cyclopropylmethyl-adenine N6-cyclopropylmethyladenine
cyh6A 6-Cyclohexyladenine N6-cyclohexyladenine
cyp6A 6-Cyclopentyladenine N6-cyclopentyladenine
daA N,N-dimethyl-Adenine N6,N6-dimethyladenine
e6A 6-Ethyladenine 2-amino-6-etoxypurine
eaA N-ethyl-adenine N6-ethyladenine
imprn2 N-(Aminopropyl)imidazoleadenine 2-(1-(3-aminopropyl)imidazole)adenine
m1A 1-Methyladenine N1-methyladenine
m2nprn 3-(Dimethylamino)propylaminoadenine N3-(dimethylamino)propylaminoadenine
meA N-Methyl-Adenine N6-methyladenine

Sugars

Symbol Old name New name
12ddR 1',2'-Di-Deoxy-Ribose 1',2'-dideoxyribose
25R 2,5-Ribose Ribose (2,5 connectivity)
3FAM 3-FAM 6-FAM (3' end)
3SS6 3'-Thiol-Modifier 6 S-S from Glen Research Thiol Modifier 6 S-S (3' end)
5cGT 2-(methylamino)acetamidate (GeneTools 5'-cap for PMO) 2-(methylamino)acetamidate (5' end)
5FAM 5'-6FAM (6-carboxyflurescein) 6-FAM (5' end)
acn4d 4-Acetylamino-2-deoxyribose N-acetyl-2-deoxyazaribose
Ae2d 2-alpha-C-ethyl-2-deoxyribose 2-ethyl-2-deoxyribose
afhna 3-ara FHNA Ara-FHNA
AlexeyGirin commented 1 month ago

Verified.

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