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VTB

VTB
Name:	7-O-phosphono-alpha-L-galacto-hept-2-ulopyranose
Formula:	C7 H15 O10 P
SMILES:	OC[C]1(O)O[CH](CO[P](O)(O)=O)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C7H15O10P/c8-2-7(12)6(11)5(10)4(9)3(17-7)1-16-18(13,14)15/h3-6,8-12H,1-2H2,(H2,13,14,15)/t3-,4+,5+,6-,7+/m0/s1
Synonyms:	[(2~{S},3~{S},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate
Definition date:	2015-06-19
Last modified:	2020-07-17
Release date:	2015-10-14
Identifier:	[(2~{S},3~{S},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate

L6S

L6S
Name:	6-O-sulfo-alpha-L-galactopyranose
Formula:	C6 H12 O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H12O9S/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3+,4+,5-,6+/m0/s1
Synonyms:	6-O-sulfo-alpha-L-galactose
Definition date:	2009-08-27
Last modified:	2020-07-17
Identifier:	6-O-sulfo-alpha-L-galactopyranose

YO5

YO5
Name:	(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
Formula:	C7 H15 O8 P
SMILES:	O=P(O)(O)CC1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C7H15O8P/c8-1-3-5(9)7(11)6(10)4(15-3)2-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4+,5-,6+,7+/m1/s1
Synonyms:	Beta-1 phosphonomethylene-D-glucopyranose
Definition date:	2013-09-09
Last modified:	2020-07-17
Release date:	2014-07-16
Identifier:	(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol

W9T

W9T
Name:	4-O-beta-D-galactopyranosyl-beta-D-fructofuranose
Formula:	C12 H22 O11
SMILES:	OC2C(OC1OC(CO)C(O)C(O)C1O)C(OC2(O)CO)CO
InChi:	InChI=1S/C12H22O11/c13-1-4-6(16)7(17)8(18)11(21-4)22-9-5(2-14)23-12(20,3-15)10(9)19/h4-11,13-20H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11+,12-/m1/s1
Definition date:	2013-04-23
Last modified:	2020-07-17
Release date:	2014-03-19
Identifier:	4-O-beta-D-galactopyranosyl-beta-D-fructofuranose

KD5

KD5
Name:	4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid
Formula:	C8 H12 O7
SMILES:	O=C(O)C(=O)CC1OC(CO)C(O)C1O
InChi:	InChI=1S/C8H12O7/c9-2-5-7(12)6(11)4(15-5)1-3(10)8(13)14/h4-7,9,11-12H,1-2H2,(H,13,14)/t4?,5-,6-,7-/m1/s1
Definition date:	2012-03-22
Last modified:	2020-07-17
Release date:	2013-03-27
Identifier:	4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid

U63

U63
Name:	2-deoxy-2-fluoro-4-O-beta-D-glucopyranosyl-beta-D-glucopyranose
Formula:	C12 H21 F O10
SMILES:	FC2C(O)C(OC1OC(C(O)C(O)C1O)CO)C(OC2O)CO
InChi:	InChI=1S/C12H21FO10/c13-5-7(17)10(4(2-15)21-11(5)20)23-12-9(19)8(18)6(16)3(1-14)22-12/h3-12,14-20H,1-2H2/t3-,4-,5-,6-,7-,8+,9-,10-,11-,12+/m1/s1
Definition date:	2014-10-06
Last modified:	2020-07-17
Release date:	2015-01-14
Identifier:	2-deoxy-2-fluoro-4-O-beta-D-glucopyranosyl-beta-D-glucopyranose

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

KDB

KDB
Name:	3,4,5-trideoxy-alpha-D-erythro-oct-3-en-2-ulopyranosonic acid
Formula:	C8 H12 O6
SMILES:	OC1(C(=O)O)C=CCC(C(CO)O)O1
InChi:	InChI=1S/C8H12O6/c9-4-5(10)6-2-1-3-8(13,14-6)7(11)12/h1,3,5-6,9-10,13H,2,4H2,(H,11,12)/t5-,6+,8-/m1/s1
Synonyms:	3,4-dehydro-3,4,5-trideoxy-alpha-D-manno-oct-2-ulosonic acid
Definition date:	2008-01-04
Last modified:	2020-07-17
Identifier:	3,4,5-trideoxy-alpha-D-erythro-oct-3-en-2-ulopyranosonic acid

Z9D

Z9D
Name:	4-deoxy-beta-D-xylo-hexopyranose
Formula:	C6 H12 O5
SMILES:	OC1CC(OC(O)C1O)CO
InChi:	InChI=1S/C6H12O5/c7-2-3-1-4(8)5(9)6(10)11-3/h3-10H,1-2H2/t3-,4-,5+,6+/m0/s1
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	4-deoxy-beta-D-xylo-hexopyranose

Z9E

Z9E
Name:	1-thio-alpha-D-glucopyranose
Formula:	C6 H12 O5 S
SMILES:	OC1C(O)C(OC(S)C1O)CO
InChi:	InChI=1S/C6H12O5S/c7-1-2-3(8)4(9)5(10)6(12)11-2/h2-10,12H,1H2/t2-,3-,4+,5-,6-/m1/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	1-thio-alpha-D-glucopyranose

KDM

KDM
Name:	deamino-alpha-neuraminic acid
Formula:	C9 H16 O9
SMILES:	OC[CH](O)[CH](O)[CH]1O[C](O)(C[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9+/m0/s1
Synonyms:	alpha-deaminoneuraminic acid
Definition date:	2010-11-26
Last modified:	2020-07-17
Identifier:	(2R,4S,5R,6R)-2,4,5-trihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

KDN

KDN
Name:	deamino-beta-neuraminic acid
Formula:	C9 H16 O9
SMILES:	O=C(O)C1(O)OC(C(O)C(O)CO)C(O)C(O)C1
InChi:	InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9-/m0/s1
Synonyms:	beta-deaminoneuraminic acid
Definition date:	2008-09-18
Last modified:	2020-07-17
Identifier:	3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid

Z9H

Z9H
Name:	3,4-di-O-methyl-2,6-di-O-sulfo-alpha-D-glucopyranose
Formula:	C8 H16 O12 S2
SMILES:	O=S(=O)(O)OCC1OC(O)C(OS(=O)(=O)O)C(OC)C1OC
InChi:	InChI=1S/C8H16O12S2/c1-16-5-4(3-18-21(10,11)12)19-8(9)7(6(5)17-2)20-22(13,14)15/h4-9H,3H2,1-2H3,(H,10,11,12)(H,13,14,15)/t4-,5-,6+,7-,8+/m1/s1
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	3,4-di-O-methyl-2,6-di-O-sulfo-alpha-D-glucopyranose

KDR

KDR
Name:	prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside
Formula:	C11 H18 O7
SMILES:	O=CC1(OCC=C)OC(C(O)CO)C(O)C(O)C1
InChi:	InChI=1S/C11H18O7/c1-2-3-17-11(6-13)4-7(14)9(16)10(18-11)8(15)5-12/h2,6-10,12,14-16H,1,3-5H2/t7-,8-,9-,10-,11-/m1/s1
Synonyms:	prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-uloside
Definition date:	2008-01-14
Last modified:	2020-07-17
Identifier:	prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside

Z9K

Z9K
Name:	3-O-methyl-2-O-sulfo-alpha-L-idopyranuronic acid
Formula:	C7 H12 O10 S
SMILES:	O=C(O)C1OC(O)C(OS(=O)(=O)O)C(OC)C1O
InChi:	InChI=1S/C7H12O10S/c1-15-3-2(8)4(6(9)10)16-7(11)5(3)17-18(12,13)14/h2-5,7-8,11H,1H3,(H,9,10)(H,12,13,14)/t2-,3-,4+,5+,7+/m0/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	3-O-methyl-2-O-sulfo-alpha-L-idopyranuronic acid

O1G

O1G
Name:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco pyranose
Formula:	C14 H22 N2 O13 P2
SMILES:	O=P(O)(O)OCc1cnc(c(O)c1/C=N/C2C(O)C(OC(O)C2O)COP(=O)(O)O)C
InChi:	InChI=1S/C14H22N2O13P2/c1-6-11(17)8(7(2-15-6)4-27-30(21,22)23)3-16-10-12(18)9(5-28-31(24,25)26)29-14(20)13(10)19/h2-3,9-10,12-14,17-20H,4-5H2,1H3,(H2,21,22,23)(H2,24,25,26)/b16-3+/t9-,10+,12-,13-,14+/m1/s1
Synonyms:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco se
Definition date:	2013-04-10
Last modified:	2020-07-17
Release date:	2013-10-16
Identifier:	3-deoxy-3-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]-6-O-phosphono-alpha-D-gluco pyranose

Z9L

Z9L
Name:	methyl 2,3,6-tri-O-sulfo-alpha-D-glucopyranoside
Formula:	C7 H14 O15 S3
SMILES:	O=S(=O)(O)OCC1OC(OC)C(OS(=O)(=O)O)C(OS(=O)(=O)O)C1O
InChi:	InChI=1S/C7H14O15S3/c1-18-7-6(22-25(15,16)17)5(21-24(12,13)14)4(8)3(20-7)2-19-23(9,10)11/h3-8H,2H2,1H3,(H,9,10,11)(H,12,13,14)(H,15,16,17)/t3-,4-,5+,6-,7+/m1/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	methyl 2,3,6-tri-O-sulfo-alpha-D-glucopyranoside

Z9M

Z9M
Name:	2-amino-2-deoxy-4-O-phosphono-beta-D-glucopyranose
Formula:	C6 H14 N O8 P
SMILES:	O=P(O)(O)OC1C(OC(O)C(N)C1O)CO
InChi:	InChI=1S/C6H14NO8P/c7-3-4(9)5(15-16(11,12)13)2(1-8)14-6(3)10/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6-/m1/s1
Synonyms:	4-O-phosphono-beta-D-glucosamine
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2015-06-24
Identifier:	2-amino-2-deoxy-4-O-phosphono-beta-D-glucopyranose

MFB

MFB
Name:	methyl beta-L-fucopyranoside
Formula:	C7 H14 O5
SMILES:	OC1C(O)C(O)C(OC1OC)C
InChi:	InChI=1S/C7H14O5/c1-3-4(8)5(9)6(10)7(11-2)12-3/h3-10H,1-2H3/t3-,4+,5+,6-,7-/m0/s1
Synonyms:	BETA-L-METHYL-FUCOSE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	methyl 6-deoxy-beta-L-galactopyranoside

Z9W

Z9W
Name:	2-acetamido-2-deoxy-beta-D-quinovopyranose
Formula:	C8 H15 N O5
SMILES:	O=C(NC1C(O)C(O)C(OC1O)C)C
InChi:	InChI=1S/C8H15NO5/c1-3-6(11)7(12)5(8(13)14-3)9-4(2)10/h3,5-8,11-13H,1-2H3,(H,9,10)/t3-,5-,6-,7-,8-/m1/s1
Synonyms:	2-acetamido-2,6-deoxy-beta-D-glucopyranose
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	2-(acetylamino)-2,6-dideoxy-beta-D-glucopyranose

ULV

ULV
Name:	4-{8-amino-3-[(6R,8aS)-3-oxohexahydro-3H-[1,3]oxazolo[3,4-a]pyridin-6-yl]imidazo[1,5-a]pyrazin-1-yl}-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide
Formula:	C26 H22 F3 N7 O3
SMILES:	n1c(c2c(nc(n2cc1)C3CCC4N(C3)C(OC4)=O)c6ccc(C(=O)Nc5nccc(C(F)(F)F)c5)cc6)N
InChi:	InChI=1S/C26H22F3N7O3/c27-26(28,29)17-7-8-31-19(11-17)33-24(37)15-3-1-14(2-4-15)20-21-22(30)32-9-10-35(21)23(34-20)16-5-6-18-13-39-25(38)36(18)12-16/h1-4,7-11,16,18H,5-6,12-13H2,(H2,30,32)(H,31,33,37)/t16-,18+/m1/s1
Definition date:	2020-05-22
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-{8-amino-3-[(6R,8aS)-3-oxohexahydro-3H-[1,3]oxazolo[3,4-a]pyridin-6-yl]imidazo[1,5-a]pyrazin-1-yl}-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide

H1M

H1M
Name:	methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannopyranoside
Formula:	C9 H18 O6
SMILES:	O(C)C1OC(C(O)C(O)C1CCO)CO
InChi:	InChI=1S/C9H18O6/c1-14-9-5(2-3-10)7(12)8(13)6(4-11)15-9/h5-13H,2-4H2,1H3/t5-,6+,7+,8+,9-/m0/s1
Synonyms:	methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannoside
Definition date:	2008-05-19
Last modified:	2020-07-17
Identifier:	methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannopyranoside

ULY

ULY
Name:	4-{8-amino-3-[(6R,8aS)-3-oxo-3,5,6,7,8,8a-hexahydroindolizin-6-yl]imidazo[1,5-a]pyrazin-1-yl}-3-methoxy-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide
Formula:	C28 H26 F3 N7 O3
SMILES:	n1ccn2c(c1N)c(nc2C3CN4C(CC3)CCC4=O)c5ccc(cc5OC)C(Nc6nccc(c6)C(F)(F)F)=O
InChi:	InChI=1S/C28H26F3N7O3/c1-41-20-12-15(27(40)35-21-13-17(8-9-33-21)28(29,30)31)3-6-19(20)23-24-25(32)34-10-11-37(24)26(36-23)16-2-4-18-5-7-22(39)38(18)14-16/h3,6,8-13,16,18H,2,4-5,7,14H2,1H3,(H2,32,34)(H,33,35,40)/t16-,18+/m1/s1
Definition date:	2020-05-22
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-{8-amino-3-[(6R,8aS)-3-oxooctahydroindolizin-6-yl]imidazo[1,5-a]pyrazin-1-yl}-3-methoxy-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide

V01

V01
Name:	N-cyclopropyl-3-oxo-N-({4-[(pyrimidin-4-yl)carbamoyl]phenyl}methyl)-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide
Formula:	C24 H21 N5 O4
SMILES:	O=C1Nc2c(OC1)cc(cc2)C(=O)N(Cc3ccc(cc3)C(Nc4ncncc4)=O)C5CC5
InChi:	InChI=1S/C24H21N5O4/c30-22-13-33-20-11-17(5-8-19(20)27-22)24(32)29(18-6-7-18)12-15-1-3-16(4-2-15)23(31)28-21-9-10-25-14-26-21/h1-5,8-11,14,18H,6-7,12-13H2,(H,27,30)(H,25,26,28,31)
Definition date:	2020-06-09
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	N-cyclopropyl-3-oxo-N-({4-[(pyrimidin-4-yl)carbamoyl]phenyl}methyl)-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide

MFU

MFU
Name:	methyl alpha-L-fucopyranoside
Formula:	C7 H14 O5
SMILES:	OC1C(O)C(O)C(OC1OC)C
InChi:	InChI=1S/C7H14O5/c1-3-4(8)5(9)6(10)7(11-2)12-3/h3-10H,1-2H3/t3-,4+,5+,6-,7+/m0/s1
Synonyms:	ALPHA-L-METHYL-FUCOSE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	methyl 6-deoxy-alpha-L-galactopyranoside

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