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PNA

PNA
Name:	4-nitrophenyl alpha-D-mannopyranoside
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:	4'-NITROPHENYL-ALPHA-D-MANNOPYRANOSIDE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	4-nitrophenyl alpha-D-mannopyranoside

SVG

SVG
Name:	(~{E})-1-(4-chlorophenyl)-~{N}-(pyridin-3-ylmethyl)ethanimine
Formula:	C14 H13 Cl N2
SMILES:	CC(=NCc1cccnc1)c2ccc(Cl)cc2
InChi:	InChI=1S/C14H13ClN2/c1-11(13-4-6-14(15)7-5-13)17-10-12-3-2-8-16-9-12/h2-9H,10H2,1H3/b17-11+
Definition date:	2020-03-11
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	(~{E})-1-(4-chlorophenyl)-~{N}-(pyridin-3-ylmethyl)ethanimine

SVJ

SVJ
Name:	(1~{S},5~{R})-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
Formula:	C8 H16 N2
SMILES:	CN1[CH]2CC[CH]1C[CH](N)C2
InChi:	InChI=1S/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3/t6-,7+,8-
Definition date:	2020-03-11
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	(1~{S},5~{R})-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

3J3

3J3
Name:	(1R)-1,5-anhydro-1-{[4-(sulfamoyloxy)piperidin-1-yl]sulfonyl}-D-galactitol
Formula:	C11 H22 N2 O10 S2
SMILES:	O=S(=O)(N1CCC(OS(=O)(=O)N)CC1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C11H22N2O10S2/c12-25(20,21)23-6-1-3-13(4-2-6)24(18,19)11-10(17)9(16)8(15)7(5-14)22-11/h6-11,14-17H,1-5H2,(H2,12,20,21)/t7-,8+,9+,10-,11-/m1/s1
Definition date:	2014-08-22
Last modified:	2020-07-17
Release date:	2014-10-15
Identifier:	(1R)-1,5-anhydro-1-{[4-(sulfamoyloxy)piperidin-1-yl]sulfonyl}-D-galactitol

3J4

3J4
Name:	(6S)-2,6-anhydro-6-{[(3R)-3-(sulfamoyloxy)pyrrolidin-1-yl]sulfonyl}-D-glucitol
Formula:	C10 H20 N2 O10 S2
SMILES:	O=S(=O)(N1CCC(OS(=O)(=O)N)C1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C10H20N2O10S2/c11-24(19,20)22-5-1-2-12(3-5)23(17,18)10-9(16)8(15)7(14)6(4-13)21-10/h5-10,13-16H,1-4H2,(H2,11,19,20)/t5-,6?,7-,8+,9+,10+/m1/s1
Definition date:	2014-08-25
Last modified:	2020-07-17
Release date:	2014-10-15
Identifier:	(6S)-2,6-anhydro-6-{[(3R)-3-(sulfamoyloxy)pyrrolidin-1-yl]sulfonyl}-D-glucitol

NL5

NL5
Name:	4-[2-(phenylsulfonyl)ethyl]-5-(propan-2-yloxymethyl)-1~{H}-1,2,3-triazole
Formula:	C14 H19 N3 O3 S
SMILES:	CC(C)OCc1[nH]nnc1CC[S](=O)(=O)c2ccccc2
InChi:	InChI=1S/C14H19N3O3S/c1-11(2)20-10-14-13(15-17-16-14)8-9-21(18,19)12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,15,16,17)
Definition date:	2019-12-04
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-[2-(phenylsulfonyl)ethyl]-5-(propan-2-yloxymethyl)-1~{H}-1,2,3-triazole

PNG

PNG
Name:	4-nitrophenyl alpha-D-glucopyranoside
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:	4'-NITROPHENYL-ALPHA-D-GLUCOPYRANOSIDE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	4-nitrophenyl alpha-D-glucopyranoside

SVM

SVM
Name:	1-[(1~{R},2~{R},4~{S})-2-bicyclo[2.2.1]heptanyl]-3-(2-pyridin-2-ylethyl)thiourea
Formula:	C15 H21 N3 S
SMILES:	S=C(NCCc1ccccn1)N[CH]2C[CH]3CC[CH]2C3
InChi:	InChI=1S/C15H21N3S/c19-15(17-8-6-13-3-1-2-7-16-13)18-14-10-11-4-5-12(14)9-11/h1-3,7,11-12,14H,4-6,8-10H2,(H2,17,18,19)/t11-,12+,14+/m0/s1
Definition date:	2020-03-11
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	1-[(1~{R},2~{R},4~{S})-2-bicyclo[2.2.1]heptanyl]-3-(2-pyridin-2-ylethyl)thiourea

PNJ

PNJ
Name:	4-nitrophenyl 2-amino-2-deoxy-beta-D-glucopyranoside
Formula:	C12 H16 N2 O7
SMILES:	N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1Oc2ccc(cc2)[N+]([O-])=O
InChi:	InChI=1S/C12H16N2O7/c13-9-11(17)10(16)8(5-15)21-12(9)20-7-3-1-6(2-4-7)14(18)19/h1-4,8-12,15-17H,5,13H2/t8-,9-,10-,11-,12-/m1/s1
Synonyms:	PNP-BETA-D-GLUCOSAMINE
Definition date:	2008-08-05
Last modified:	2020-07-17
Identifier:	(2~{R},3~{S},4~{R},5~{R},6~{S})-5-azanyl-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4-diol

YX0

YX0
Name:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl alpha-L-fucopyranoside
Formula:	C12 H19 N O7
SMILES:	O(CC=1ONC(=C(O)C)C=1)C2OC(C(O)C(O)C2O)C
InChi:	InChI=1S/C12H19NO7/c1-5(14)8-3-7(20-13-8)4-18-12-11(17)10(16)9(15)6(2)19-12/h3,6,9-17H,4H2,1-2H3/b8-5+/t6-,9+,10+,11-,12+/m0/s1
Synonyms:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside
Definition date:	2008-05-22
Last modified:	2020-07-17
Identifier:	[(3E)-3-(1-hydroxyethylidene)-2,3-dihydroisoxazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside

XDX

XDX
Name:	(2R)-2-(alpha-D-glucopyranosyloxy)-3-(phosphonooxy)propanoic acid
Formula:	C9 H17 O12 P
SMILES:	OP(O)(=O)OCC(C(O)=O)OC1C(C(C(C(O1)CO)O)O)O
InChi:	InChI=1S/C9H17O12P/c10-1-3-5(11)6(12)7(13)9(20-3)21-4(8(14)15)2-19-22(16,17)18/h3-7,9-13H,1-2H2,(H,14,15)(H2,16,17,18)/t3-,4-,5-,6+,7-,9-/m1/s1
Synonyms:	(2R)-2-(alpha-D-glucosyloxy)-3-(phosphonooxy)propanoic acid
Definition date:	2016-05-10
Last modified:	2020-07-17
Release date:	2017-05-24
Identifier:	(2R)-2-(alpha-D-glucopyranosyloxy)-3-(phosphonooxy)propanoic acid

YX1

YX1
Name:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose
Formula:	C8 H17 N3 O7
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)N(NO)C
InChi:	InChI=1S/C8H17N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,10,12-15,17H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7-/m1/s1
Synonyms:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucose
Definition date:	2008-05-29
Last modified:	2020-07-17
Identifier:	2-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-beta-D-glucopyranose

NLC

NLC
Name:	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE
Formula:	C14 H25 N O11
SMILES:	O=C(NC2C(O)C(OC1OC(C(O)C(O)C1O)CO)C(OC2O)CO)C
InChi:	InChI=1S/C14H25NO11/c1-4(18)15-7-9(20)12(6(3-17)24-13(7)23)26-14-11(22)10(21)8(19)5(2-16)25-14/h5-14,16-17,19-23H,2-3H2,1H3,(H,15,18)/t5-,6-,7-,8+,9-,10+,11-,12-,13+,14+/m1/s1
Definition date:	2004-07-15
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-4-O-beta-D-galactopyranosyl-alpha-D-glucopyranose

SHB

SHB
Name:	methyl beta-D-galactopyranuronate
Formula:	C7 H12 O7
SMILES:	O=C(OC)C1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C7H12O7/c1-13-7(12)5-3(9)2(8)4(10)6(11)14-5/h2-6,8-11H,1H3/t2-,3+,4+,5-,6+/m0/s1
Definition date:	2009-01-17
Last modified:	2020-07-17
Identifier:	methyl beta-D-galactopyranuronate

SHD

SHD
Name:	alpha-D-altropyranose
Formula:	C6 H12 O6
SMILES:	OC1C(O)C(OC(O)C1O)CO
InChi:	InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5+,6+/m1/s1
Synonyms:	alpha-D-altrose
Definition date:	2009-01-17
Last modified:	2020-07-17
Identifier:	alpha-D-altropyranose

XS2

XS2
Name:	METHYL4,4II,4III,4IV-TETRATHIO-BETA-D-XYLOPENTOSIDE
Formula:	C26 H44 O17 S4
SMILES:	S(C2COC(SC1C(O)C(O)C(OC)OC1)C(O)C2O)C5OCC(SC4OCC(SC3OCC(O)C(O)C3O)C(O)C4O)C(O)C5O
InChi:	InChI=1S/C26H44O17S4/c1-38-22-17(33)13(29)8(3-39-22)44-24-19(35)15(31)10(5-41-24)46-26-21(37)16(32)11(6-43-26)47-25-20(36)14(30)9(4-42-25)45-23-18(34)12(28)7(27)2-40-23/h7-37H,2-6H2,1H3/t7?,8-,9?,10-,11-,12?,13+,14?,15+,16+,17-,18?,19-,20?,21-,22+,23?,24+,25?,26+/m1/s1
Definition date:	2004-10-14
Last modified:	2020-07-17
Identifier:	methyl pentopyranosyl-(1->4)-4-thiopentopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-alpha-D-xylopyranoside

PNW

PNW
Name:	4-nitrophenyl beta-D-glucopyranoside
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:	4'-NITROPHENYL-BETA-D-GLUCOPYRANOSIDE
Definition date:	2010-05-25
Last modified:	2020-07-17
Identifier:	4-nitrophenyl beta-D-glucopyranoside

SWD

SWD
Name:	4-chloranylthieno[3,2-d]pyrimidine
Formula:	C6 H3 Cl N2 S
SMILES:	Clc1ncnc2ccsc12
InChi:	InChI=1S/C6H3ClN2S/c7-6-5-4(1-2-10-5)8-3-9-6/h1-3H
Definition date:	2020-03-11
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-chloranylthieno[3,2-d]pyrimidine

SWE

SWE
Name:	alpha-D-fructofuranosyl alpha-D-glucopyranoside
Formula:	C12 H22 O11
SMILES:	O1C(CO)C(O)C(O)C(O)C1OC2(OC(C(O)C2O)CO)CO
InChi:	InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12-/m1/s1
Definition date:	2009-09-17
Last modified:	2020-07-17
Identifier:	alpha-D-fructofuranosyl alpha-D-glucopyranoside

NM6

NM6
Name:	2-acetamido-3-O-[(2R)-1-amino-1-oxopropan-2-yl]-2-deoxy-beta-D-glucopyranose
Formula:	C11 H20 N2 O7
SMILES:	O=C(N)C(OC1C(O)C(OC(O)C1NC(=O)C)CO)C
InChi:	InChI=1S/C11H20N2O7/c1-4(10(12)17)19-9-7(13-5(2)15)11(18)20-6(3-14)8(9)16/h4,6-9,11,14,16,18H,3H2,1-2H3,(H2,12,17)(H,13,15)/t4-,6-,7-,8-,9-,11-/m1/s1
Synonyms:	(2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-2-(hydroxymethyl)-3,6-bis(oxidanyl)oxan-4-yl]oxypropanamide
Definition date:	2013-11-19
Last modified:	2020-07-17
Release date:	2014-07-23
Identifier:	2-(acetylamino)-3-O-[(2R)-1-amino-1-oxopropan-2-yl]-2-deoxy-beta-D-glucopyranose

B4G

B4G
Name:	GALACTOTRIOSE
Formula:	C18 H32 O16
SMILES:	O(C1C(OC(O)C(O)C1O)CO)C3OC(C(OC2OC(CO)C(O)C(O)C2O)C(O)C3O)CO
InChi:	InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7+,8+,9-,10-,11-,12-,13-,14+,15+,16-,17+,18+/m1/s1
Synonyms:	BETA-1,4-GALACTOTRIOSIDE
Definition date:	2003-10-23
Last modified:	2020-07-17
Identifier:	beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranose

NM9

NM9
Name:	methyl 2-acetamido-3-O-[(2R)-1-amino-1-oxopropan-2-yl]-2-deoxy-beta-D-glucopyranoside
Formula:	C12 H22 N2 O7
SMILES:	O=C(N)C(OC1C(O)C(OC(OC)C1NC(=O)C)CO)C
InChi:	InChI=1S/C12H22N2O7/c1-5(11(13)18)20-10-8(14-6(2)16)12(19-3)21-7(4-15)9(10)17/h5,7-10,12,15,17H,4H2,1-3H3,(H2,13,18)(H,14,16)/t5-,7-,8-,9-,10-,12-/m1/s1
Synonyms:	(2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-2-(hydroxymethyl)-6-methoxy-3-oxidanyl-oxan-4-yl]oxypropanamide
Definition date:	2013-11-19
Last modified:	2020-07-17
Release date:	2014-07-23
Identifier:	methyl 2-(acetylamino)-3-O-[(2R)-1-amino-1-oxopropan-2-yl]-2-deoxy-beta-D-glucopyranoside

SID

SID
Name:	methyl 9-S-acetyl-5-acetamido-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Formula:	C14 H23 N O9 S
SMILES:	O=C(SCC(O)C(O)C1OC(OC)(C(=O)O)CC(O)C1NC(=O)C)C
InChi:	InChI=1S/C14H23NO9S/c1-6(16)15-10-8(18)4-14(23-3,13(21)22)24-12(10)11(20)9(19)5-25-7(2)17/h8-12,18-20H,4-5H2,1-3H3,(H,15,16)(H,21,22)/t8-,9+,10+,11+,12+,14+/m0/s1
Synonyms:	methyl 9-S-acetyl-5-(acetylamino)-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Definition date:	2009-07-24
Last modified:	2020-07-17
Identifier:	methyl 9-S-acetyl-5-(acetylamino)-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid

YYB

YYB
Name:	1,5-anhydro-3-O-methyl-2,6-di-O-sulfo-D-glucitol
Formula:	C7 H14 O11 S2
SMILES:	O=S(=O)(O)OCC1OCC(OS(=O)(=O)O)C(OC)C1O
InChi:	InChI=1S/C7H14O11S2/c1-15-7-5(18-20(12,13)14)2-16-4(6(7)8)3-17-19(9,10)11/h4-8H,2-3H2,1H3,(H,9,10,11)(H,12,13,14)/t4-,5+,6-,7-/m1/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	1,5-anhydro-3-O-methyl-2,6-di-O-sulfo-D-glucitol

YYH

YYH
Name:	7-deoxy-L-glycero-alpha-D-manno-heptopyranose
Formula:	C7 H14 O6
SMILES:	OC1C(O)C(OC(O)C1O)C(O)C
InChi:	InChI=1S/C7H14O6/c1-2(8)6-4(10)3(9)5(11)7(12)13-6/h2-12H,1H3/t2-,3-,4-,5-,6+,7-/m0/s1
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	7-deoxy-L-glycero-alpha-D-manno-heptopyranose

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