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U8V

U8V
Name:	6-O-butanoyl-alpha-D-glucopyranose
Formula:	C10 H18 O7
SMILES:	OC1C(C(O)C(O)C(COC(=O)CCC)O1)O
InChi:	InChI=1S/C10H18O7/c1-2-3-6(11)16-4-5-7(12)8(13)9(14)10(15)17-5/h5,7-10,12-15H,2-4H2,1H3/t5-,7-,8+,9-,10+/m1/s1
Definition date:	2020-05-04
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	6-O-butanoyl-alpha-D-glucopyranose

Z3U

Z3U
Name:	beta-D-Digitoxopyranose
Formula:	C6 H12 O4
SMILES:	OC1C(OC(O)CC1O)C
InChi:	InChI=1S/C6H12O4/c1-3-6(9)4(7)2-5(8)10-3/h3-9H,2H2,1H3/t3-,4+,5-,6-/m1/s1
Synonyms:	beta-D-Digitoxose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	2,6-dideoxy-beta-D-ribo-hexopyranose

TFU

TFU
Name:	methyl 1-seleno-beta-L-fucopyranoside
Formula:	C7 H14 O4 Se
SMILES:	C[Se][CH]1O[CH](C)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C7H14O4Se/c1-3-4(8)5(9)6(10)7(11-3)12-2/h3-10H,1-2H3/t3-,4+,5+,6-,7+/m0/s1
Synonyms:	(2S,3S,4R,5S,6R)-2-methyl-6-methylselanyl-oxane-3,4,5-triol
Definition date:	2015-11-12
Last modified:	2020-07-17
Release date:	2016-06-29
Identifier:	(2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-methylselanyl-oxane-3,4,5-triol

S7P

S7P
Name:	1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrofuranose
Formula:	C7 H15 O10 P
SMILES:	O=P(O)(O)OCC(O)C1OC(O)(CO)C(O)C1O
InChi:	InChI=1S/C7H15O10P/c8-2-7(12)6(11)4(10)5(17-7)3(9)1-16-18(13,14)15/h3-6,8-12H,1-2H2,(H2,13,14,15)/t3-,4-,5-,6+,7-/m1/s1
Synonyms:	1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrose
Definition date:	2014-08-28
Last modified:	2020-07-17
Release date:	2015-08-12
Identifier:	1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrofuranose

SMD

SMD
Name:	METHYL-2-S-(ALPHA-D-MANNOPYRANOSYL)-2-THIO-ALPHA-D-MANNOPYRANOSIDE
Formula:	C13 H24 O10 S
SMILES:	S(C1C(OC)OC(CO)C(O)C1O)C2OC(C(O)C(O)C2O)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
Definition date:	2004-09-03
Last modified:	2020-07-17
Identifier:	methyl 2-S-alpha-D-mannopyranosyl-2-thio-alpha-D-mannopyranoside

Z4K

Z4K
Name:	2-O-sulfo-alpha-D-glucopyranose
Formula:	C6 H12 O9 S
SMILES:	O=S(=O)(OC1C(O)C(O)C(OC1O)CO)O
InChi:	InChI=1S/C6H12O9S/c7-1-2-3(8)4(9)5(6(10)14-2)15-16(11,12)13/h2-10H,1H2,(H,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
Synonyms:	2-O-sulfo-alpha-D-glucose
Definition date:	2012-12-17
Last modified:	2020-07-17
Release date:	2016-11-02
Identifier:	2-O-sulfo-alpha-D-glucopyranose

Z4R

Z4R
Name:	methyl 3-thio-alpha-D-mannopyranoside
Formula:	C7 H14 O5 S
SMILES:	OC1C(S)C(O)C(OC1OC)CO
InChi:	InChI=1S/C7H14O5S/c1-11-7-5(10)6(13)4(9)3(2-8)12-7/h3-10,13H,2H2,1H3/t3-,4-,5+,6+,7+/m1/s1
Definition date:	2012-12-19
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	methyl 3-thio-alpha-D-mannopyranoside

Z4S

Z4S
Name:	1,6-anhydro-N-acetyl-beta-D-glucopyranosamine
Formula:	C8 H13 N O5
SMILES:	O=C(NC2C(O)C(O)C1OC2OC1)C
InChi:	InChI=1S/C8H13NO5/c1-3(10)9-5-7(12)6(11)4-2-13-8(5)14-4/h4-8,11-12H,2H2,1H3,(H,9,10)/t4-,5-,6-,7-,8-/m1/s1
Synonyms:	N-[(1R,2S,3R,4R,5R)-2,3-bis(oxidanyl)-6,8-dioxabicyclo[3.2.1]octan-4-yl]ethanamide
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2018-03-14
Identifier:	N-[(1R,2S,3R,4R,5R)-2,3-dihydroxy-6,8-dioxabicyclo[3.2.1]oct-4-yl]acetamide (non-preferred name)

TUG

TUG
Name:	3,4-di-O-sulfo-alpha-D-altropyranose
Formula:	C6 H12 O12 S2
SMILES:	OCC1OC(C(C(C1OS(=O)(O)=O)OS(=O)(O)=O)O)O
InChi:	InChI=1S/C6H12O12S2/c7-1-2-4(17-19(10,11)12)5(18-20(13,14)15)3(8)6(9)16-2/h2-9H,1H2,(H,10,11,12)(H,13,14,15)/t2-,3+,4-,5+,6+/m1/s1
Definition date:	2020-03-31
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	3,4-di-O-sulfo-alpha-D-altropyranose

Z4U

Z4U
Name:	methyl 4-thio-alpha-D-xylopyranoside
Formula:	C6 H12 O4 S
SMILES:	OC1C(O)C(S)COC1OC
InChi:	InChI=1S/C6H12O4S/c1-9-6-5(8)4(7)3(11)2-10-6/h3-8,11H,2H2,1H3/t3-,4+,5-,6+/m1/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	methyl 4-thio-alpha-D-xylopyranoside

U97

U97
Name:	2-O-sulfo-beta-L-galactopyranuronic acid
Formula:	C6 H10 O10 S
SMILES:	C1(C(C(=O)O)OC(O)C(C1O)OS(O)(=O)=O)O
InChi:	InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2+,3+,4-,6-/m0/s1
Definition date:	2020-05-04
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	2-O-sulfo-beta-L-galactopyranuronic acid

Z4V

Z4V
Name:	4-thio-beta-L-ribopyranose
Formula:	C5 H10 O4 S
SMILES:	OC1C(S)COC(O)C1O
InChi:	InChI=1S/C5H10O4S/c6-3-2(10)1-9-5(8)4(3)7/h2-8,10H,1H2/t2-,3-,4-,5-/m0/s1
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	4-thio-beta-L-ribopyranose

TUJ

TUJ
Name:	1,2,3,4-tetra-O-sulfo-alpha-D-allopyranose
Formula:	C6 H12 O18 S4
SMILES:	OCC1OC(C(C(C1OS(O)(=O)=O)OS(=O)(=O)O)OS(O)(=O)=O)OS(O)(=O)=O
InChi:	InChI=1S/C6H12O18S4/c7-1-2-3(21-25(8,9)10)4(22-26(11,12)13)5(23-27(14,15)16)6(20-2)24-28(17,18)19/h2-7H,1H2,(H,8,9,10)(H,11,12,13)(H,14,15,16)(H,17,18,19)/t2-,3-,4-,5-,6-/m1/s1
Definition date:	2020-03-31
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	1,2,3,4-tetra-O-sulfo-alpha-D-allopyranose

U9A

U9A
Name:	[(2R,3R,4R,5R,6R)-2,4,5-trihydroxy-6-(sulfooxy)tetrahydro-2H-pyran-3-yl]sulfamic acid
Formula:	C5 H11 N O11 S2
SMILES:	C1(C(C(NS(O)(=O)=O)C(OC1OS(O)(=O)=O)O)O)O
InChi:	InChI=1S/C5H11NO11S2/c7-2-1(6-18(10,11)12)4(9)16-5(3(2)8)17-19(13,14)15/h1-9H,(H,10,11,12)(H,13,14,15)/t1-,2-,3-,4-,5-/m1/s1
Definition date:	2020-05-04
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	[(2R,3R,4R,5R,6R)-2,4,5-trihydroxy-6-(sulfooxy)tetrahydro-2H-pyran-3-yl]sulfamic acid (non-preferred name)

S81

S81
Name:	(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucopyranoside
Formula:	C12 H25 F N4 O5
SMILES:	C1(C(C(O)C(F)C(CN)O1)N)OC2C(C(O)C(N)CC2N)O
InChi:	InChI=1S/C12H25FN4O5/c13-6-5(2-14)21-12(7(17)9(6)19)22-11-4(16)1-3(15)8(18)10(11)20/h3-12,18-20H,1-2,14-17H2/t3-,4+,5-,6-,7-,8+,9+,10-,11-,12-/m1/s1
Synonyms:	(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucoside
Definition date:	2015-06-17
Last modified:	2020-07-17
Release date:	2016-06-22
Identifier:	(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucopyranoside

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

U9D

U9D
Name:	4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose
Formula:	C9 H18 O5
SMILES:	C1C(OC(C(C1OC)OC)O)COC
InChi:	InChI=1S/C9H18O5/c1-11-5-6-4-7(12-2)8(13-3)9(10)14-6/h6-10H,4-5H2,1-3H3/t6-,7-,8+,9?/m0/s1
Definition date:	2020-05-05
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose

TUP

TUP
Name:	3-deoxy-3-fluoro-alpha-D-glucopyranose
Formula:	C6 H11 F O5
SMILES:	FC1C(C(O)OC(C1O)CO)O
InChi:	InChI=1S/C6H11FO5/c7-3-4(9)2(1-8)12-6(11)5(3)10/h2-6,8-11H,1H2/t2-,3+,4-,5-,6+/m1/s1
Definition date:	2020-03-31
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	3-deoxy-3-fluoro-alpha-D-glucopyranose

XIL

XIL
Name:	(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside
Formula:	C10 H17 N O7
SMILES:	O=C2NCCC(OC1OCC(O)C(O)C1O)C2O
InChi:	InChI=1S/C10H17NO7/c12-4-3-17-10(8(15)6(4)13)18-5-1-2-11-9(16)7(5)14/h4-8,10,12-15H,1-3H2,(H,11,16)/t4-,5-,6+,7+,8-,10+/m1/s1
Synonyms:	3-HYDROXY-4-(3,4,5-TRIHYDROXY-TETRAHYDRO-PYRAN-2-YLOXY)-PIPERIDIN-2-ONE
Definition date:	2002-10-28
Last modified:	2020-07-17
Identifier:	(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside

X4S

X4S
Name:	beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyr anose
Formula:	C20 H34 O14 S3
SMILES:	S(C2COC(SC1C(O)C(O)C(O)OC1)C(O)C2O)C4OCC(SC3OCC(O)C(O)C3O)C(O)C4O
InChi:	InChI=1S/C20H34O14S3/c21-5-1-32-18(14(27)9(5)22)36-7-3-34-20(16(29)11(7)24)37-8-4-33-19(15(28)12(8)25)35-6-2-31-17(30)13(26)10(6)23/h5-30H,1-4H2/t5-,6-,7-,8-,9+,10+,11+,12+,13-,14-,15-,16-,17-,18+,19+,20+/m1/s1
Synonyms:	thio-linked xylotetraose
Definition date:	2008-06-18
Last modified:	2020-07-17
Identifier:	beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranosyl-(1->4)-4-thio-beta-D-xylopyranose

TUR

TUR
Name:	3-O-alpha-D-glucopyranosyl-alpha-D-fructofuranose
Formula:	C12 H22 O11
SMILES:	O(C1C(O)C(OC1(O)CO)CO)C2OC(CO)C(O)C(O)C2O
InChi:	InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)22-10-7(17)5(2-14)23-12(10,20)3-15/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
Definition date:	2011-11-01
Last modified:	2020-07-17
Identifier:	3-O-alpha-D-glucopyranosyl-alpha-D-fructofuranose

U9G

U9G
Name:	2,3-di-O-methyl-6-O-sulfo-alpha-D-glucopyranose
Formula:	C8 H16 O9 S
SMILES:	OC1C(OC(C(C1OC)OC)O)COS(O)(=O)=O
InChi:	InChI=1S/C8H16O9S/c1-14-6-5(9)4(3-16-18(11,12)13)17-8(10)7(6)15-2/h4-10H,3H2,1-2H3,(H,11,12,13)/t4-,5-,6+,7-,8+/m1/s1
Definition date:	2020-05-05
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	2,3-di-O-methyl-6-O-sulfo-alpha-D-glucopyranose

SMV

SMV
Name:	thiophene-2-carbothioamide
Formula:	C5 H5 N S2
SMILES:	NC(=S)c1sccc1
InChi:	InChI=1S/C5H5NS2/c6-5(7)4-2-1-3-8-4/h1-3H,(H2,6,7)
Definition date:	2020-03-11
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	thiophene-2-carbothioamide

U9J

U9J
Name:	(2R,3R,4S,5S,6R)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol
Formula:	C8 H16 O7
SMILES:	OC1C(OC(C(C1OC)OC)O)C(O)O
InChi:	InChI=1S/C8H16O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-12H,1-2H3/t3-,4-,5+,6+,8+/m0/s1
Definition date:	2020-05-05
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	(2R,3R,4S,5S,6R)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol (non-preferred name)

Z5J

Z5J
Name:	beta-L-Olivopyranose
Formula:	C6 H12 O4
SMILES:	OC1C(OC(O)CC1O)C
InChi:	InChI=1S/C6H12O4/c1-3-6(9)4(7)2-5(8)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6-/m0/s1
Synonyms:	beta-L-Olivose
Definition date:	2012-12-18
Last modified:	2020-07-17
Release date:	2020-07-29
Identifier:	2,6-dideoxy-beta-L-arabino-hexopyranose

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