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N1A

N1A
Name:	5-fluoro-N-[5-(4-methylpiperazin-1-yl)pyridin-2-yl]-4-[(4R)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine
Formula:	C23 H29 F N8
SMILES:	C5Cn1c(c(cn1)c2c(F)cnc(n2)Nc3ccc(cn3)N4CCN(CC4)C)C(C)CC5
InChi:	InChI=1S/C23H29FN8/c1-16-5-3-4-8-32-22(16)18(14-27-32)21-19(24)15-26-23(29-21)28-20-7-6-17(13-25-20)31-11-9-30(2)10-12-31/h6-7,13-16H,3-5,8-12H2,1-2H3,(H,25,26,28,29)/t16-/m1/s1
Definition date:	2019-04-29
Last modified:	2020-07-24
Release date:	2020-07-29
Identifier:	5-fluoro-N-[5-(4-methylpiperazin-1-yl)pyridin-2-yl]-4-[(4R)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine

N1J

N1J
Name:	N-[5-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)pyridin-2-yl]-5-fluoro-4-[(4R)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine
Formula:	C25 H31 F N8
SMILES:	C6C1(CN(C1)c5ccc(Nc4ncc(F)c(c3c2n(CCCCC2C)nc3)n4)nc5)CN6CC
InChi:	InChI=1S/C25H31FN8/c1-3-32-13-25(14-32)15-33(16-25)18-7-8-21(27-10-18)30-24-28-12-20(26)22(31-24)19-11-29-34-9-5-4-6-17(2)23(19)34/h7-8,10-12,17H,3-6,9,13-16H2,1-2H3,(H,27,28,30,31)/t17-/m1/s1
Definition date:	2019-04-29
Last modified:	2020-07-24
Release date:	2020-07-29
Identifier:	N-[5-(6-ethyl-2,6-diazaspiro[3.3]heptan-2-yl)pyridin-2-yl]-5-fluoro-4-[(4R)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine

QB8

QB8
Name:	~{N}-[1-[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]indol-6-yl]ethanamide
Formula:	C20 H17 N7 O
SMILES:	CC(=O)Nc1ccc2ccn(c3cc(NC4CC4)n5ncc(C#N)c5n3)c2c1
InChi:	InChI=1S/C20H17N7O/c1-12(28)23-16-3-2-13-6-7-26(17(13)8-16)18-9-19(24-15-4-5-15)27-20(25-18)14(10-21)11-22-27/h2-3,6-9,11,15,24H,4-5H2,1H3,(H,23,28)
Definition date:	2020-06-02
Last modified:	2020-07-24
Release date:	2020-07-29
Identifier:	~{N}-[1-[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]indol-6-yl]ethanamide

QBE

QBE
Name:	~{N}-[5-[[3-cyano-7-(cyclopropylamino)-3~{H}-pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-methyl-phenyl]propanamide
Formula:	C20 H21 N7 O
SMILES:	CCC(=O)Nc1cc(Nc2cc(NC3CC3)n4ncc(C#N)c4n2)ccc1C
InChi:	InChI=1S/C20H21N7O/c1-3-19(28)25-16-8-15(5-4-12(16)2)23-17-9-18(24-14-6-7-14)27-20(26-17)13(10-21)11-22-27/h4-5,8-9,11,14,24H,3,6-7H2,1-2H3,(H,23,26)(H,25,28)
Definition date:	2020-06-02
Last modified:	2020-07-24
Release date:	2020-07-29
Identifier:	~{N}-[5-[[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-methyl-phenyl]propanamide

GYV

GYV
Name:	2-acetamido-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose
Formula:	C9 H16 N2 O7
SMILES:	O=C(OC1OC(C(O)C(O)C1NC(=O)C)CO)N
InChi:	InChI=1S/C9H16N2O7/c1-3(13)11-5-7(15)6(14)4(2-12)17-8(5)18-9(10)16/h4-8,12,14-15H,2H2,1H3,(H2,10,16)(H,11,13)/t4-,5-,6-,7-,8-/m1/s1
Synonyms:	2-(ACETYLAMINO)-1-O-CARBAMOYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSE
Definition date:	2010-01-26
Last modified:	2020-07-18
Identifier:	2-(acetylamino)-1-O-carbamoyl-2-deoxy-alpha-D-glucopyranose

YYM

YYM
Name:	alpha-D-ribopyranose
Formula:	C5 H10 O5
SMILES:	OC1C(O)COC(O)C1O
InChi:	InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3-,4-,5+/m1/s1
Synonyms:	alpha-D-ribose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	alpha-D-ribopyranose

Z0F

Z0F
Name:	alpha-L-idopyranose
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+/m0/s1
Synonyms:	alpha-L-idose
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	alpha-L-idopyranose

Z15

Z15
Name:	(1S)-1,5-anhydro-1-(4-chloro-2,5-dihydroxyphenyl)-D-glucitol
Formula:	C12 H15 Cl O7
SMILES:	Clc1c(O)cc(c(O)c1)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H15ClO7/c13-5-2-6(15)4(1-7(5)16)12-11(19)10(18)9(17)8(3-14)20-12/h1-2,8-12,14-19H,3H2/t8-,9-,10+,11-,12+/m1/s1
Definition date:	2010-07-01
Last modified:	2020-07-17
Identifier:	(1S)-1,5-anhydro-1-(4-chloro-2,5-dihydroxyphenyl)-D-glucitol

Z16

Z16
Name:	(1S)-1,5-anhydro-1-(3-chloro-2,5-dihydroxyphenyl)-D-glucitol
Formula:	C12 H15 Cl O7
SMILES:	Clc1cc(O)cc(c1O)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H15ClO7/c13-6-2-4(15)1-5(8(6)16)12-11(19)10(18)9(17)7(3-14)20-12/h1-2,7,9-12,14-19H,3H2/t7-,9-,10+,11-,12+/m1/s1
Definition date:	2010-07-01
Last modified:	2020-07-17
Identifier:	(1S)-1,5-anhydro-1-(3-chloro-2,5-dihydroxyphenyl)-D-glucitol

Z2D

Z2D
Name:	alpha-L-allopyranose
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+/m0/s1
Synonyms:	alpha-L-allose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	alpha-L-allopyranose

Z2T

Z2T
Name:	(1S)-1,5-anhydro-1-(3-chloro-2-hydroxy-5-methoxyphenyl)-D-glucitol
Formula:	C13 H17 Cl O7
SMILES:	Clc1cc(OC)cc(c1O)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C13H17ClO7/c1-20-5-2-6(9(16)7(14)3-5)13-12(19)11(18)10(17)8(4-15)21-13/h2-3,8,10-13,15-19H,4H2,1H3/t8-,10-,11+,12-,13+/m1/s1
Definition date:	2010-07-01
Last modified:	2020-07-17
Identifier:	(1S)-1,5-anhydro-1-(3-chloro-2-hydroxy-5-methoxyphenyl)-D-glucitol

Z57

Z57
Name:	(1S)-1,5-anhydro-1-(4-bromo-2,5-dihydroxyphenyl)-D-glucitol
Formula:	C12 H15 Br O7
SMILES:	Brc1c(O)cc(c(O)c1)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H15BrO7/c13-5-2-6(15)4(1-7(5)16)12-11(19)10(18)9(17)8(3-14)20-12/h1-2,8-12,14-19H,3H2/t8-,9-,10+,11-,12+/m1/s1
Definition date:	2010-07-01
Last modified:	2020-07-17
Identifier:	(1S)-1,5-anhydro-1-(4-bromo-2,5-dihydroxyphenyl)-D-glucitol

Z6H

Z6H
Name:	alpha-L-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+/m0/s1
Synonyms:	alpha-L-altrose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2019-05-15
Identifier:	alpha-L-altropyranose

Z6J

Z6J
Name:	alpha-L-ribofuranose
Formula:	C5 H10 O5
SMILES:	OC1C(OC(O)C1O)CO
InChi:	InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5+/m0/s1
Synonyms:	alpha-L-ribose
Definition date:	2012-12-19
Last modified:	2020-07-17
Release date:	2014-05-28
Identifier:	alpha-L-ribofuranose

Z9N

Z9N
Name:	alpha-D-fructofuranose
Formula:	C6 H12 O6
SMILES:	OC1C(O)C(OC1(O)CO)CO
InChi:	InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5+,6+/m1/s1
Synonyms:	alpha-D-fructose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2019-10-30
Identifier:	alpha-D-fructofuranose

ZCD

ZCD
Name:	alpha-D-idopyranose
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-idose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	alpha-D-idopyranose

G1P

G1P
Name:	1-O-phosphono-alpha-D-glucopyranose
Formula:	C6 H13 O9 P
SMILES:	O=P(O)(OC1OC(C(O)C(O)C1O)CO)O
InChi:	InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
Synonyms:	ALPHA-D-GLUCOSE-1-PHOSPHATE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	1-O-phosphono-alpha-D-glucopyranose

G2F

G2F
Name:	2-deoxy-2-fluoro-alpha-D-glucopyranose
Formula:	C6 H11 F O5
SMILES:	FC1C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4-,5-,6+/m1/s1
Synonyms:	2-deoxy-2-fluoro-alpha-D-glucose
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	2-deoxy-2-fluoro-alpha-D-glucopyranose

G4D

G4D
Name:	4-deoxy-alpha-D-glucopyranose
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
Synonyms:	4-DEOXY-ALPHA-D-GLUCOSE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	4-deoxy-alpha-D-xylo-hexopyranose

G6D

G6D
Name:	alpha-D-quinovopyranose
Formula:	C6 H12 O5
SMILES:	C1(C(O)C(O)C(O)C(O1)C)O
InChi:	InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5-,6+/m1/s1
Synonyms:	alpha-D-quinovose
Definition date:	1999-08-04
Last modified:	2020-07-17
Identifier:	6-deoxy-alpha-D-glucopyranose

G6P

G6P
Name:	6-O-phosphono-alpha-D-glucopyranose
Formula:	C6 H13 O9 P
SMILES:	O=P(O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
Synonyms:	ALPHA-D-GLUCOSE-6-PHOSPHATE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	6-O-phosphono-alpha-D-glucopyranose

GAA

GAA
Name:	3-nitrophenyl alpha-D-galactopyranoside
Formula:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2cc(OC1OC(C(O)C(O)C1O)CO)ccc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12+/m1/s1
Synonyms:	METANITROPHENYL-ALPHA-D-GALACTOSIDE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	3-nitrophenyl alpha-D-galactopyranoside

GAF

GAF
Name:	2-deoxy-2-fluoro-alpha-D-galactopyranose
Formula:	C6 H11 F O5
SMILES:	FC1C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
Synonyms:	2-DEOXY-2-FLUORO-GALACTOSE
Definition date:	2004-02-11
Last modified:	2020-07-17
Identifier:	2-deoxy-2-fluoro-alpha-D-galactopyranose

GAT

GAT
Name:	4-aminophenyl alpha-D-galactopyranoside
Formula:	C12 H17 N O6
SMILES:	O(c1ccc(N)cc1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9+,10+,11-,12+/m1/s1
Synonyms:	4'-AMINOPHENYL-ALPHA-D-GALACTOPYRANOSIDE
Definition date:	2000-02-09
Last modified:	2020-07-17
Identifier:	4-aminophenyl alpha-D-galactopyranoside

GCD

GCD
Name:	4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid
Formula:	C6 H8 O6
SMILES:	O=C(O)C=1OC(O)C(O)C(O)C=1
InChi:	InChI=1S/C6H8O6/c7-2-1-3(5(9)10)12-6(11)4(2)8/h1-2,4,6-8,11H,(H,9,10)/t2-,4+,6+/m0/s1
Synonyms:	4,5-DEHYDRO-D-GLUCURONIC ACID
Definition date:	2000-12-14
Last modified:	2020-07-17
Identifier:	4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid

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