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3S6

3S6
Name:	prop-2-en-1-yl beta-D-galactofuranoside
Formula:	C9 H16 O6
SMILES:	O(C/C=C)C1OC(C(O)C1O)C(O)CO
InChi:	InChI=1S/C9H16O6/c1-2-3-14-9-7(13)6(12)8(15-9)5(11)4-10/h2,5-13H,1,3-4H2/t5-,6-,7-,8+,9-/m1/s1
Synonyms:	prop-2-en-1-yl beta-D-galactoside
Definition date:	2014-10-16
Last modified:	2020-07-17
Release date:	2015-07-01
Identifier:	prop-2-en-1-yl beta-D-galactofuranoside

3SA

3SA
Name:	ACARBOSE DERIVED TRISACCHARIDE
Formula:	C19 H33 N O13
SMILES:	OC3C(OC2OC(C)C(NC1C=C(CO)C(O)C(O)C1O)C(O)C2O)C(OC(O)C3O)CO
InChi:	InChI=1S/C19H33NO13/c1-5-9(20-7-2-6(3-21)10(23)13(26)11(7)24)12(25)16(29)19(31-5)33-17-8(4-22)32-18(30)15(28)14(17)27/h2,5,7-30H,3-4H2,1H3/t5-,7+,8-,9-,10-,11+,12+,13+,14-,15-,16-,17-,18+,19-/m1/s1
Synonyms:	4-O-(4,6-DIDEOXY-4-{[4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)CYCLOHEX-2-EN-1-YL]AMINO}-BETA-D-LYXO-HEXOPYRANOSYL)-ALPHA-D-ERY THRO-HEXOPYRANOSE
Definition date:	2004-09-15
Last modified:	2020-07-17
Identifier:	4-O-(4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl)-alpha-D-glucopyranose

HSG

HSG
Name:	octyl alpha-L-altropyranoside
Formula:	C14 H28 O6
SMILES:	O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12-,13+,14+/m0/s1
Synonyms:	octyl alpha-L-altroside
Definition date:	2009-01-14
Last modified:	2020-07-17
Identifier:	octyl alpha-L-altropyranoside

HSH

HSH
Name:	octyl beta-D-galactopyranoside
Formula:	C14 H28 O6
SMILES:	O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13-,14-/m1/s1
Synonyms:	octyl beta-D-galactoside
Definition date:	2009-01-14
Last modified:	2020-07-17
Identifier:	octyl beta-D-galactopyranoside

HSJ

HSJ
Name:	octyl beta-L-talopyranoside
Formula:	C14 H28 O6
SMILES:	O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13+,14-/m0/s1
Synonyms:	octyl beta-L-taloside
Definition date:	2009-01-14
Last modified:	2020-07-17
Release date:	2014-07-30
Identifier:	octyl beta-L-talopyranoside

HSQ

HSQ
Name:	2-acetylamino-2-deoxy-alpha-L-idopyranose
Formula:	C8 H15 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:	InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7+,8+/m0/s1
Synonyms:	N-acetyl-alpha-L-idosamine
Definition date:	2009-01-16
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-alpha-L-idopyranose

HSX

HSX
Name:	5-O-phosphono-alpha-D-ribofuranose
Formula:	C5 H11 O8 P
SMILES:	O=P(O)(O)OCC1OC(O)C(O)C1O
InChi:	InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5+/m1/s1
Synonyms:	5-O-phosphono-alpha-D-ribose
Definition date:	2009-01-16
Last modified:	2020-07-17
Identifier:	5-O-phosphono-alpha-D-ribofuranose

HSY

HSY
Name:	alpha-L-xylopyranose
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+/m0/s1
Synonyms:	alpha-L-xylose
Definition date:	2009-01-16
Last modified:	2020-07-17
Identifier:	alpha-L-xylopyranose

HTG

HTG
Name:	heptyl 1-thio-beta-D-glucopyranoside
Formula:	C13 H26 O5 S
SMILES:	S(CCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C13H26O5S/c1-2-3-4-5-6-7-19-13-12(17)11(16)10(15)9(8-14)18-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13+/m1/s1
Synonyms:	HEPTYL 1-THIOHEXOPYRANOSIDE
Definition date:	2004-07-21
Last modified:	2020-07-17
Identifier:	heptyl 1-thio-beta-D-glucopyranoside

HTM

HTM
Name:	3-hydroxypropyl 2-acetamido-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid
Formula:	C11 H17 N O7
SMILES:	O=C(C1=CC(C(C(O1)OCCCO)NC(C)=O)O)O
InChi:	InChI=1S/C11H17NO7/c1-6(14)12-9-7(15)5-8(10(16)17)19-11(9)18-4-2-3-13/h5,7,9,11,13,15H,2-4H2,1H3,(H,12,14)(H,16,17)/t7-,9+,11+/m0/s1
Synonyms:	6-(3-HYDROXYPROPOXY)-5-ACETAMIDO-5,6-DIHYDRO-4-HYDROXY-4H-PYRAN-2-CARBOXYLIC ACID
Definition date:	2005-11-28
Last modified:	2020-07-17
Identifier:	3-hydroxypropyl 2-(acetylamino)-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid

3YW

3YW
Name:	(2S)-2,3-dihydroxypropyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
Formula:	C11 H21 N O8
SMILES:	O=C(NC1C(O)C(O)C(OC1OCC(O)CO)CO)C
InChi:	InChI=1S/C11H21NO8/c1-5(15)12-8-10(18)9(17)7(3-14)20-11(8)19-4-6(16)2-13/h6-11,13-14,16-18H,2-4H2,1H3,(H,12,15)/t6-,7+,8+,9+,10+,11-/m0/s1
Synonyms:	(2S)-2,3-dihydroxypropyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
Definition date:	2014-12-10
Last modified:	2020-07-17
Release date:	2015-02-25
Identifier:	(2S)-2,3-dihydroxypropyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside

40J

40J
Name:	1,6-dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactopyranoside
Formula:	C12 H19 Cl3 O8
SMILES:	ClC2C(OC(OC1(OC(C(O)C1O)CCl)CCl)C(O)C2O)CO
InChi:	InChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1
Synonyms:	sucralose
Definition date:	2015-01-02
Last modified:	2020-07-17
Release date:	2015-12-23
Identifier:	1,6-dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactopyranoside

7NU

7NU
Name:	phenyl 6,7-anhydro-D-glycero-beta-D-galacto-heptopyranoside
Formula:	C13 H16 O6
SMILES:	O[CH]1[CH](O)[CH](O[CH]([CH]2CO2)[CH]1O)Oc3ccccc3
InChi:	InChI=1S/C13H16O6/c14-9-10(15)12(8-6-17-8)19-13(11(9)16)18-7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9+,10-,11-,12-,13-/m1/s1
Synonyms:	Phenyl 6,7-dideoxy-6,7-epoxy-beta-D-galacto-heptopyranoside(6D)
Definition date:	2016-11-28
Last modified:	2020-07-17
Release date:	2017-10-11
Identifier:	(2~{S},3~{R},4~{S},5~{R},6~{S})-2-[(2~{R})-oxiran-2-yl]-6-phenoxy-oxane-3,4,5-triol

QPS

QPS
Name:	BETA-ACARBOSE
Formula:	C25 H43 N O18
SMILES:	O(C1C(OC(O)C(O)C1O)CO)C4OC(C(OC3OC(C)C(NC2C=C(CO)C(O)C(O)C2O)C(O)C3O)C(O)C4O)CO
InChi:	InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/m1/s1
Synonyms:	4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4) -alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranose
Definition date:	2008-06-03
Last modified:	2020-07-17
Identifier:	4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranose

QW7

QW7
Name:	1-[(1R)-1-(2,6-dichloro-3-methoxyphenyl)ethyl]-6-{2-[(2R)-piperidin-2-yl]phenyl}-1H-benzimidazole
Formula:	C27 H27 Cl2 N3 O
SMILES:	CC(c1c(ccc(c1Cl)OC)Cl)n5cnc4ccc(c3c(C2NCCCC2)cccc3)cc45
InChi:	InChI=1S/C27H27Cl2N3O/c1-17(26-21(28)11-13-25(33-2)27(26)29)32-16-31-23-12-10-18(15-24(23)32)19-7-3-4-8-20(19)22-9-5-6-14-30-22/h3-4,7-8,10-13,15-17,22,30H,5-6,9,14H2,1-2H3/t17-,22-/m1/s1
Definition date:	2020-01-03
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	1-[(1R)-1-(2,6-dichloro-3-methoxyphenyl)ethyl]-6-{2-[(2R)-piperidin-2-yl]phenyl}-1H-benzimidazole

R1P

R1P
Name:	1-O-phosphono-alpha-D-ribofuranose
Formula:	C5 H11 O8 P
SMILES:	O=P(OC1OC(C(O)C1O)CO)(O)O
InChi:	InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
Synonyms:	RIBOSE-1-PHOSPHATE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	1-O-phosphono-alpha-D-ribofuranose

R1X

R1X
Name:	1,4-anhydro-D-ribitol
Formula:	C5 H10 O4
SMILES:	OCC1OCC(O)C1O
InChi:	InChI=1S/C5H10O4/c6-1-4-5(8)3(7)2-9-4/h3-8H,1-2H2/t3-,4+,5-/m0/s1
Synonyms:	1-deoxyribose
Definition date:	2008-10-03
Last modified:	2020-07-17
Identifier:	1,4-anhydro-D-ribitol

4U0

4U0
Name:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->6)-beta-D-gal actopyranosyl-(1->4)-beta-D-glucopyranose
Formula:	C23 H39 N O19
SMILES:	C2(C(O)C(C(OC1C(CO)OC(O)C(C1O)O)OC2COC3(OC(C(C(C3)O)NC(=O)C)C(C(CO)O)O)C(O)=O)O)O
InChi:	InChI=1S/C23H39NO19/c1-6(27)24-11-7(28)2-23(22(37)38,43-19(11)12(30)8(29)3-25)39-5-10-13(31)14(32)17(35)21(41-10)42-18-9(4-26)40-20(36)16(34)15(18)33/h7-21,25-26,28-36H,2-5H2,1H3,(H,24,27)(H,37,38)/t7-,8+,9+,10+,11+,12+,13-,14-,15+,16+,17+,18+,19+,20+,21-,23+/m0/s1
Definition date:	2015-05-27
Last modified:	2020-07-17
Release date:	2015-11-18
Identifier:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->6)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranose

4U1

4U1
Name:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->6)-beta-D-gal actopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose
Formula:	C25 H42 N2 O19
SMILES:	C2(C(O)C(C(OC1C(C(NC(C)=O)C(OC1CO)O)O)OC2COC3(OC(C(C(C3)O)NC(=O)C)C(C(CO)O)O)C(O)=O)O)O
InChi:	InChI=1S/C25H42N2O19/c1-7(30)26-13-9(32)3-25(24(40)41,46-21(13)15(34)10(33)4-28)42-6-12-16(35)18(37)19(38)23(44-12)45-20-11(5-29)43-22(39)14(17(20)36)27-8(2)31/h9-23,28-29,32-39H,3-6H2,1-2H3,(H,26,30)(H,27,31)(H,40,41)/t9-,10+,11+,12+,13+,14+,15+,16-,17+,18-,19+,20+,21+,22+,23-,25+/m0/s1
Definition date:	2015-05-27
Last modified:	2020-07-17
Release date:	2015-11-18
Identifier:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->6)-beta-D-galactopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose

4U2

4U2
Name:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->3)-beta-D-gal actopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose
Formula:	C25 H42 N2 O19
SMILES:	C2(C(C(C(OC1C(C(NC(C)=O)C(OC1CO)O)O)OC2CO)O)OC3(OC(C(C(C3)O)NC(=O)C)C(O)C(CO)O)C(O)=O)O
InChi:	InChI=1S/C25H42N2O19/c1-7(31)26-13-9(33)3-25(24(40)41,45-20(13)15(35)10(34)4-28)46-21-16(36)11(5-29)43-23(18(21)38)44-19-12(6-30)42-22(39)14(17(19)37)27-8(2)32/h9-23,28-30,33-39H,3-6H2,1-2H3,(H,26,31)(H,27,32)(H,40,41)/t9-,10+,11+,12+,13+,14+,15+,16-,17+,18+,19+,20+,21-,22+,23-,25-/m0/s1
Definition date:	2015-05-27
Last modified:	2020-07-17
Release date:	2015-11-18
Identifier:	(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose

R2B

R2B
Name:	1,4-anhydro-D-erythro-pent-1-enitol
Formula:	C5 H8 O4
SMILES:	OC1=COC(CO)C1O
InChi:	InChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h2,4-8H,1H2/t4-,5+/m1/s1
Definition date:	2005-05-11
Last modified:	2020-07-17
Identifier:	1,4-anhydro-D-erythro-pent-1-enitol

R2G

R2G
Name:	2,5-anhydro-4-deoxy-D-erythro-pent-4-enitol
Formula:	C5 H8 O3
SMILES:	OC[CH]1OC=C[CH]1O
InChi:	InChI=1S/C5H8O3/c6-3-5-4(7)1-2-8-5/h1-2,4-7H,3H2/t4-,5+/m1/s1
Definition date:	2009-12-09
Last modified:	2020-07-17
Identifier:	(2~{S},3~{R})-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol

4UZ

4UZ
Name:	2-{[(benzyloxy)carbonyl]amino}-2-deoxy-beta-D-glucopyranose
Formula:	C14 H19 N O7
SMILES:	C2(O)C(NC(OCc1ccccc1)=O)C(OC(C2O)CO)O
InChi:	InChI=1S/C14H19NO7/c16-6-9-11(17)12(18)10(13(19)22-9)15-14(20)21-7-8-4-2-1-3-5-8/h1-5,9-13,16-19H,6-7H2,(H,15,20)/t9-,10-,11-,12-,13-/m1/s1
Synonyms:	N-[(benzyloxy)carbonyl]-beta-D-glucosamine
Definition date:	2015-06-02
Last modified:	2020-07-17
Release date:	2015-06-17
Identifier:	2-{[(benzyloxy)carbonyl]amino}-2-deoxy-beta-D-glucopyranose

4V5

4V5
Name:	2-deoxy-2-{[3-(4-hydroxyphenyl)propanoyl]amino}-alpha-D-glucopyranose
Formula:	C15 H21 N O7
SMILES:	c2cc(CCC(NC1C(C(C(OC1O)CO)O)O)=O)ccc2O
InChi:	InChI=1S/C15H21NO7/c17-7-10-13(20)14(21)12(15(22)23-10)16-11(19)6-3-8-1-4-9(18)5-2-8/h1-2,4-5,10,12-15,17-18,20-22H,3,6-7H2,(H,16,19)/t10-,12-,13-,14-,15+/m1/s1
Synonyms:	N-[3-(4-hydroxyphenyl)propanoyl]-alpha-D-glucosamine
Definition date:	2015-06-04
Last modified:	2020-07-17
Release date:	2015-06-17
Identifier:	2-deoxy-2-{[3-(4-hydroxyphenyl)propanoyl]amino}-alpha-D-glucopyranose

OAK

OAK
Name:	N-(phenylcarbonyl)-beta-D-glucopyranosylamine
Formula:	C13 H17 N O6
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)c2ccccc2
InChi:	InChI=1S/C13H17NO6/c15-6-8-9(16)10(17)11(18)13(20-8)14-12(19)7-4-2-1-3-5-7/h1-5,8-11,13,15-18H,6H2,(H,14,19)/t8-,9-,10+,11-,13-/m1/s1
Synonyms:	N-(phenylcarbonyl)-beta-D-glucosylamine
Definition date:	2009-02-05
Last modified:	2020-07-17
Identifier:	N-(phenylcarbonyl)-beta-D-glucopyranosylamine

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