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0NZ

0NZ
Name:	2-deoxy-6-O-phosphono-beta-D-glucopyranose
Formula:	C6 H13 O8 P
SMILES:	O=P(O)(O)OCC1OC(O)CC(O)C1O
InChi:	InChI=1S/C6H13O8P/c7-3-1-5(8)14-4(6(3)9)2-13-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5-,6+/m1/s1
Synonyms:	2-deoxy-6-O-phosphono-beta-D-arabino-hexopyranose
Definition date:	2012-08-17
Last modified:	2020-07-17
Release date:	2013-06-12
Identifier:	2-deoxy-6-O-phosphono-beta-D-arabino-hexopyranose

E3M

E3M
Name:	(1R)-4-acetamido-3-amino-1,5-anhydro-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol
Formula:	C10 H20 N2 O8 S
SMILES:	C1(OC(C(C(C1)N)NC(C)=O)C(C(CO)O)O)S(O)(=O)=O
InChi:	InChI=1S/C10H20N2O8S/c1-4(14)12-8-5(11)2-7(21(17,18)19)20-10(8)9(16)6(15)3-13/h5-10,13,15-16H,2-3,11H2,1H3,(H,12,14)(H,17,18,19)/t5-,6+,7+,8+,9+,10+/m0/s1
Synonyms:	(1R)-4-(acetylamino)-3-amino-1,5-anhydro-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol
Definition date:	2017-11-30
Last modified:	2020-07-17
Release date:	2018-03-07
Identifier:	(1R)-4-(acetylamino)-3-amino-1,5-anhydro-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol

0TS

0TS
Name:	beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyrano syl-(1->4)-1-thio-beta-D-glucopyranose
Formula:	C30 H52 O23 S3
SMILES:	S(C2C(OC(OC1C(O)C(O)C(S)OC1CO)C(O)C2O)CO)C5OC(C(OC4OC(CO)C(SC3OC(CO)C(O)C(O)C3O)C(O)C4O)C(O)C5O)CO
InChi:	InChI=1S/C30H52O23S3/c31-1-6-11(36)12(37)20(45)29(50-6)55-24-9(4-34)48-27(18(43)15(24)40)53-23-8(3-33)51-30(21(46)14(23)39)56-25-10(5-35)47-26(17(42)16(25)41)52-22-7(2-32)49-28(54)19(44)13(22)38/h6-46,54H,1-5H2/t6-,7-,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26+,27+,28+,29+,30+/m1/s1
Synonyms:	hemithiocellodextrin
Definition date:	2012-06-08
Last modified:	2020-07-17
Identifier:	beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-1-thio-beta-D-glucopyranose

0UB

0UB
Name:	beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranose
Formula:	C18 H32 O16
SMILES:	O3C(COC1(OC(C(O)C1O)COC2(OC(CO)C(O)C2O)CO)CO)C(O)C(O)C3(O)CO
InChi:	InChI=1S/C18H32O16/c19-1-7-10(23)14(27)17(5-21,33-7)31-3-9-12(25)15(28)18(6-22,34-9)30-2-8-11(24)13(26)16(29,4-20)32-8/h7-15,19-29H,1-6H2/t7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-/m1/s1
Synonyms:	Levantriose
Definition date:	2012-06-15
Last modified:	2020-07-17
Identifier:	beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranose

E5G

E5G
Name:	5-hydroxypentyl alpha-D-glucopyranoside
Formula:	C11 H22 O7
SMILES:	O(CCCCCO)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C11H22O7/c12-4-2-1-3-5-17-11-10(16)9(15)8(14)7(6-13)18-11/h7-16H,1-6H2/t7-,8-,9+,10-,11+/m1/s1
Synonyms:	5-hydroxypentyl alpha-D-glucoside
Definition date:	2012-01-11
Last modified:	2020-07-17
Identifier:	5-hydroxypentyl alpha-D-glucopyranoside

0WK

0WK
Name:	1,5-anhydro-6-O-phosphono-D-glucitol
Formula:	C6 H13 O8 P
SMILES:	O=P(O)(O)OCC1OCC(O)C(O)C1O
InChi:	InChI=1S/C6H13O8P/c7-3-1-13-4(6(9)5(3)8)2-14-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4+,5+,6+/m0/s1
Definition date:	2012-07-24
Last modified:	2020-07-17
Release date:	2013-07-03
Identifier:	1,5-anhydro-6-O-phosphono-D-glucitol

EAG

EAG
Name:	2-aminoethyl 2-acetamido-2-deoxy-beta-D-glucopyranoside
Formula:	C10 H20 N2 O6
SMILES:	O=C(NC1C(O)C(O)C(OC1OCCN)CO)C
InChi:	InChI=1S/C10H20N2O6/c1-5(14)12-7-9(16)8(15)6(4-13)18-10(7)17-3-2-11/h6-10,13,15-16H,2-4,11H2,1H3,(H,12,14)/t6-,7-,8-,9-,10-/m1/s1
Synonyms:	2-aminoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside
Definition date:	2008-01-23
Last modified:	2020-07-17
Identifier:	2-aminoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside

EBG

EBG
Name:	2-[(2S)-oxiran-2-yl]ethyl alpha-D-glucopyranoside
Formula:	C10 H18 O7
SMILES:	O(CCC1OC1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C10H18O7/c11-3-6-7(12)8(13)9(14)10(17-6)15-2-1-5-4-16-5/h5-14H,1-4H2/t5-,6+,7+,8-,9+,10-/m0/s1
Synonyms:	2-HYDROXYMETHYL-6-(2-OXIRANYL-ETHOXY)-TETRAHYDRO-PYRAN-3,4,5-TRIOL
Definition date:	2002-11-28
Last modified:	2020-07-17
Identifier:	2-[(2S)-oxiran-2-yl]ethyl alpha-D-glucopyranoside

12E

12E
Name:	N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazino]carbonothioyl}-beta-D-glucopyranosylamine
Formula:	C13 H18 N4 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccncc2
InChi:	InChI=1S/C13H18N4O5S/c18-6-8-9(19)10(20)11(21)12(22-8)16-13(23)17-15-5-7-1-3-14-4-2-7/h1-5,8-12,18-21H,6H2,(H2,16,17,23)/b15-5+/t8-,9-,10+,11-,12-/m1/s1
Synonyms:	4-pyridinecarboxaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-04-30
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

145

145
Name:	2-nitrophenyl beta-D-galactopyranoside
Formula:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2c(OC1OC(C(O)C(O)C1O)CO)cccc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Synonyms:	1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE
Definition date:	2001-09-26
Last modified:	2020-07-17
Identifier:	2-nitrophenyl beta-D-galactopyranoside

147

147
Name:	4-nitrophenyl beta-D-galactopyranoside
Formula:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1O)CO)cc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Synonyms:	1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE
Definition date:	2001-09-27
Last modified:	2020-07-17
Identifier:	4-nitrophenyl beta-D-galactopyranoside

149

149
Name:	D-galactonolactone
Formula:	C6 H10 O6
SMILES:	O=C1OC(CO)C(O)C(O)C1O
InChi:	InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3+,4+,5-/m1/s1
Synonyms:	(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one
Definition date:	2001-10-02
Last modified:	2020-07-17
Identifier:	(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one (non-preferred name)

14T

14T
Name:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside
Formula:	C14 H15 F4 N O6
SMILES:	FC(F)C(=O)NC2C(O)C(O)C(OC2Oc1cc(F)c(F)cc1)CO
InChi:	InChI=1S/C14H15F4NO6/c15-6-2-1-5(3-7(6)16)24-14-9(19-13(23)12(17)18)11(22)10(21)8(4-20)25-14/h1-3,8-12,14,20-22H,4H2,(H,19,23)/t8-,9-,10-,11-,14-/m1/s1
Synonyms:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucoside
Definition date:	2009-12-08
Last modified:	2020-07-17
Identifier:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside

15L

15L
Name:	D-galactaro-1,5-lactone
Formula:	C6 H8 O7
SMILES:	O=C(O)C1OC(=O)C(O)C(O)C1O
InChi:	InChI=1S/C6H8O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,7-9H,(H,10,11)/t1-,2+,3+,4-/m0/s1
Synonyms:	galactaro-1,5-lactone
Definition date:	2011-04-11
Last modified:	2020-07-17
Identifier:	(2S,3R,4S,5R)-3,4,5-trihydroxy-6-oxotetrahydro-2H-pyran-2-carboxylic acid (non-preferred name)

16F

16F
Name:	N-({(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:	C14 H19 N3 O6 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=Cc2cccc(O)c2
InChi:	InChI=1S/C14H19N3O6S/c18-6-9-10(20)11(21)12(22)13(23-9)16-14(24)17-15-5-7-2-1-3-8(19)4-7/h1-5,9-13,18-22H,6H2,(H2,16,17,24)/b15-5-/t9-,10-,11+,12-,13-/m1/s1
Synonyms:	3-hydroxybenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-04-30
Last modified:	2020-07-17
Identifier:	N-{[(2Z)-2-(3-hydroxybenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

16G

16G
Name:	2-acetamido-2-deoxy-6-O-phosphono-alpha-D-glucopyranose
Formula:	C8 H16 N O9 P
SMILES:	O=P(O)(O)OCC1OC(O)C(NC(=O)C)C(O)C1O
InChi:	InChI=1S/C8H16NO9P/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H2,14,15,16)/t4-,5-,6-,7-,8+/m1/s1
Synonyms:	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE
Definition date:	2000-09-13
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-phosphono-alpha-D-glucopyranose

16O

16O
Name:	N-({(2E)-2-[(4-bromophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:	C14 H18 Br N3 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(Br)cc2
InChi:	InChI=1S/C14H18BrN3O5S/c15-8-3-1-7(2-4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:	4-bromobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-05-03
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(4-bromobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

17T

17T
Name:	N-({(2E)-2-[(4-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:	C14 H18 Cl N3 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(Cl)cc2
InChi:	InChI=1S/C14H18ClN3O5S/c15-8-3-1-7(2-4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:	N-({(2E)-2-[(4-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucosylamine
Definition date:	2010-05-03
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(4-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

JRV

JRV
Name:	methyl 6-S-beta-D-glucopyranosyl-6-thio-beta-D-glucopyranoside
Formula:	C13 H24 O10 S
SMILES:	C1(OC(C(O)C(C1O)O)SCC2OC(C(C(C2O)O)O)OC)CO
InChi:	InChI=1S/C13H24O10S/c1-21-12-10(19)8(17)7(16)5(22-12)3-24-13-11(20)9(18)6(15)4(2-14)23-13/h4-20H,2-3H2,1H3/t4-,5-,6-,7-,8+,9+,10-,11-,12-,13+/m1/s1
Synonyms:	METHYL 6-THIO-BETA-GENTIOBIOSIDE
Definition date:	2018-09-19
Last modified:	2020-07-17
Release date:	2019-05-29
Identifier:	methyl 6-S-beta-D-glucopyranosyl-6-thio-beta-D-glucopyranoside

18D

18D
Name:	3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid
Formula:	C12 H21 N O9
SMILES:	O=C(O)C1(O)OC(C(O)C(O)CO)C(NC(=O)CC)C(O)C1
InChi:	InChI=1S/C12H21NO9/c1-2-7(17)13-8-5(15)3-12(21,11(19)20)22-10(8)9(18)6(16)4-14/h5-6,8-10,14-16,18,21H,2-4H2,1H3,(H,13,17)(H,19,20)/t5-,6+,8+,9+,10+,12+/m0/s1
Synonyms:	3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulosonic acid
Definition date:	2009-04-27
Last modified:	2020-07-17
Identifier:	3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid

JS2

JS2
Name:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribofuranose
Formula:	C14 H23 N5 O12 P2
SMILES:	O=C3NC=Nc1c3nc(N)n1CCCCOP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O
InChi:	InChI=1S/C14H23N5O12P2/c15-14-18-8-11(16-6-17-12(8)22)19(14)3-1-2-4-28-32(24,25)31-33(26,27)29-5-7-9(20)10(21)13(23)30-7/h6-7,9-10,13,20-21,23H,1-5H2,(H2,15,18)(H,24,25)(H,26,27)(H,16,17,22)/t7-,9-,10-,13+/m1/s1
Synonyms:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribose
Definition date:	2014-06-18
Last modified:	2020-07-17
Release date:	2015-05-13
Identifier:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribofuranose

18O

18O
Name:	N-({(2E)-2-[(4-nitrophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:	C14 H18 N4 O7 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc([N+]([O-])=O)cc2
InChi:	InChI=1S/C14H18N4O7S/c19-6-9-10(20)11(21)12(22)13(25-9)16-14(26)17-15-5-7-1-3-8(4-2-7)18(23)24/h1-5,9-13,19-22H,6H2,(H2,16,17,26)/b15-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:	4-nitrobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-05-03
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(4-nitrobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

JSV

JSV
Name:	methyl 2-S-beta-D-glucopyranosyl-2-thio-beta-D-glucopyranoside
Formula:	C13 H24 O10 S
SMILES:	OC1C(OC(C(C1O)O)CO)SC2C(O)C(O)C(OC2OC)CO
InChi:	InChI=1S/C13H24O10S/c1-21-12-11(9(19)7(17)4(2-14)22-12)24-13-10(20)8(18)6(16)5(3-15)23-13/h4-20H,2-3H2,1H3/t4-,5-,6-,7-,8+,9+,10-,11-,12-,13+/m1/s1
Synonyms:	METHYL 2-THIO-BETA-SOPHOROSIDE
Definition date:	2018-09-20
Last modified:	2020-07-17
Release date:	2019-05-29
Identifier:	methyl 2-S-beta-D-glucopyranosyl-2-thio-beta-D-glucopyranoside

JV4

JV4
Name:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose
Formula:	C6 H12 F O8 P
SMILES:	C1(C(C(OC(C1O)CF)OP(O)(=O)O)O)O
InChi:	InChI=1S/C6H12FO8P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-6,8-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
Synonyms:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucose
Definition date:	2018-09-28
Last modified:	2020-07-17
Release date:	2019-07-31
Identifier:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose

JVA

JVA
Name:	2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol
Formula:	C7 H14 F O7 P
SMILES:	C1(OC(C(C(C1F)O)O)CO)CP(O)(O)=O
InChi:	InChI=1S/C7H14FO7P/c8-5-4(2-16(12,13)14)15-3(1-9)6(10)7(5)11/h3-7,9-11H,1-2H2,(H2,12,13,14)/t3-,4-,5-,6-,7-/m1/s1
Definition date:	2018-10-01
Last modified:	2020-07-17
Release date:	2019-07-31
Identifier:	2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol

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