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7IF

7IF
Name:	N-[5-(aminomethyl)-4-(2-methoxyethylamino)pyridin-2-yl]-7-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
Formula:	C20 H23 F3 N6 O3
SMILES:	COCCNc1cc(NC(=O)N2CCCc3ccc(nc23)C(=O)C(F)(F)F)ncc1CN
InChi:	InChI=1S/C20H23F3N6O3/c1-32-8-6-25-15-9-16(26-11-13(15)10-24)28-19(31)29-7-2-3-12-4-5-14(27-18(12)29)17(30)20(21,22)23/h4-5,9,11H,2-3,6-8,10,24H2,1H3,(H2,25,26,28,31)
Definition date:	2021-10-05
Last modified:	2024-09-27
Release date:	2022-02-23
Identifier:	~{N}-[5-(aminomethyl)-4-(2-methoxyethylamino)pyridin-2-yl]-7-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-2~{H}-1,8-naphthyridine-1-carboxamide

7IM

7IM
Name:	N-[(2S)-3-{[(1S)-1-carboxy-2-phenylethyl]amino}-2-methyl-3-oxopropanoyl]-L-threonyl-N-[(3S,4S)-1,3-dihydroxy-6-methylheptan-4-yl]-L-allothreoninamide
Formula:	C29 H46 N4 O10
SMILES:	O=C(NC(CC(C)C)C(O)CCO)C(NC(=O)C(NC(=O)C(C(=O)NC(C(=O)O)Cc1ccccc1)C)C(O)C)C(O)C
InChi:	InChI=1S/C29H46N4O10/c1-15(2)13-20(22(37)11-12-34)30-27(40)23(17(4)35)33-28(41)24(18(5)36)32-26(39)16(3)25(38)31-21(29(42)43)14-19-9-7-6-8-10-19/h6-10,15-18,20-24,34-37H,11-14H2,1-5H3,(H,30,40)(H,31,38)(H,32,39)(H,33,41)(H,42,43)/t16-,17+,18-,20+,21+,22+,23+,24+/m1/s1
Synonyms:	Macyranone-A
Definition date:	2015-02-10
Last modified:	2024-09-27
Release date:	2015-02-18
Identifier:	N-[(2S)-3-{[(1S)-1-carboxy-2-phenylethyl]amino}-2-methyl-3-oxopropanoyl]-L-threonyl-N-[(3S,4S)-1,3-dihydroxy-6-methylheptan-4-yl]-L-allothreoninamide

7J8

7J8
Name:	3-[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-3-(3-hydroxy-3-oxopropyl)-5-methyl-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-1~{H}-pyrrol-3-yl]propanoic acid
Formula:	C40 H46 N4 O16
SMILES:	Cc1[nH]c(Cc2[nH]c(Cc3[nH]c(Cc4[nH]cc(CCC(O)=O)c4CC(O)=O)c(CCC(O)=O)c3CC(O)=O)c(CCC(O)=O)c2CC(O)=O)c(CCC(O)=O)c1CC(O)=O
InChi:	InChI=1S/C40H46N4O16/c1-18-23(10-37(53)54)20(3-7-34(47)48)28(42-18)15-31-26(13-40(59)60)22(5-9-36(51)52)30(44-31)16-32-25(12-39(57)58)21(4-8-35(49)50)29(43-32)14-27-24(11-38(55)56)19(17-41-27)2-6-33(45)46/h17,41-44H,2-16H2,1H3,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)
Definition date:	2016-11-01
Last modified:	2024-09-27
Release date:	2017-11-15
Identifier:	3-[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-3-(3-hydroxy-3-oxopropyl)-5-methyl-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-1~{H}-pyrrol-3-yl]propanoic acid

7JZ

7JZ
Name:	2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose
Formula:	C6 H10 F2 O5
SMILES:	FC1(F)C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H10F2O5/c7-6(8)4(11)3(10)2(1-9)13-5(6)12/h2-5,9-12H,1H2/t2-,3+,4+,5-/m1/s1
Synonyms:	2-DEOXY-2,2-DIFLUORO-BETA-D-GALACTOPYRANOSYL-ENZYME INTERMEDIATE
Definition date:	2009-05-19
Last modified:	2024-09-27
Identifier:	2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose

7K8

7K8
Name:	[(2~{R},3~{S},5~{R})-5-[(4~{E})-4-hydroxyimino-2-oxidanylidene-1,3-diazinan-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate
Formula:	C9 H16 N3 O8 P
SMILES:	ON=C1CCN([CH]2C[CH](O)[CH](CO[P](O)(O)=O)O2)C(=O)N1
InChi:	InChI=1S/C9H16N3O8P/c13-5-3-8(20-6(5)4-19-21(16,17)18)12-2-1-7(11-15)10-9(12)14/h5-6,8,13,15H,1-4H2,(H,10,11,14)(H2,16,17,18)/t5-,6+,8+/m0/s1
Definition date:	2016-11-03
Last modified:	2024-09-27
Release date:	2017-12-20
Identifier:	[(2~{R},3~{S},5~{R})-5-[(4~{E})-4-hydroxyimino-2-oxidanylidene-1,3-diazinan-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

7KH

7KH
Name:	~{N}-cyclopentyl-~{N}-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-(iminomethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
Formula:	C21 H26 N8 O
SMILES:	N=Cc1nc(nc(n1)N(Cc2cn3ccccc3n2)C4CCCC4)N5CCOCC5
InChi:	InChI=1S/C21H26N8O/c22-13-18-24-20(27-9-11-30-12-10-27)26-21(25-18)29(17-5-1-2-6-17)15-16-14-28-8-4-3-7-19(28)23-16/h3-4,7-8,13-14,17,22H,1-2,5-6,9-12,15H2/b22-13+
Definition date:	2016-11-04
Last modified:	2024-09-27
Release date:	2017-01-11
Identifier:	~{N}-cyclopentyl-~{N}-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-(iminomethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine

7KN

7KN
Name:	[4-[cyclopentyl(pyrazin-2-ylmethyl)amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]methylideneazanide
Formula:	C18 H23 N8 O
SMILES:	[N-]=Cc1nc(nc(n1)N(Cc2cnccn2)C3CCCC3)N4CCOCC4
InChi:	InChI=1S/C18H23N8O/c19-11-16-22-17(25-7-9-27-10-8-25)24-18(23-16)26(15-3-1-2-4-15)13-14-12-20-5-6-21-14/h5-6,11-12,15H,1-4,7-10,13H2/q-1
Definition date:	2016-11-04
Last modified:	2024-09-27
Release date:	2017-01-11
Identifier:	[4-[cyclopentyl(pyrazin-2-ylmethyl)amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]methylideneazanide

7KU

7KU
Name:	1-{(3R)-3-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}propan-1-one
Formula:	C14 H19 N5 O
SMILES:	n3c2ncnc(NC1CCCN(C1)C(CC)=O)c2cc3
InChi:	InChI=1S/C14H19N5O/c1-2-12(20)19-7-3-4-10(8-19)18-14-11-5-6-15-13(11)16-9-17-14/h5-6,9-10H,2-4,7-8H2,1H3,(H2,15,16,17,18)/t10-/m1/s1
Definition date:	2016-11-07
Last modified:	2024-09-27
Release date:	2017-02-22
Identifier:	1-{(3R)-3-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}propan-1-one

7KV

7KV
Name:	1-[(3aR,7aR)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydro-6H-pyrrolo[2,3-c]pyridin-6-yl]propan-1-one
Formula:	C16 H21 N5 O
SMILES:	n2c1ncnc(c1cc2)N3CCC4C3CN(C(=O)CC)CC4
InChi:	InChI=1S/C16H21N5O/c1-2-14(22)20-7-4-11-5-8-21(13(11)9-20)16-12-3-6-17-15(12)18-10-19-16/h3,6,10-11,13H,2,4-5,7-9H2,1H3,(H,17,18,19)/t11-,13-/m0/s1
Definition date:	2016-11-07
Last modified:	2024-09-27
Release date:	2017-02-22
Identifier:	1-[(3aR,7aR)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydro-6H-pyrrolo[2,3-c]pyridin-6-yl]propan-1-one

7MG

7MG
Name:	7N-METHYL-8-HYDROGUANOSINE-5'-MONOPHOSPHATE
Formula:	C11 H18 N5 O8 P
SMILES:	O=C1C=2N(CN(C=2N=C(N)N1)C3OC(C(O)C3O)COP(=O)(O)O)C
InChi:	InChI=1S/C11H18N5O8P/c1-15-3-16(8-5(15)9(19)14-11(12)13-8)10-7(18)6(17)4(24-10)2-23-25(20,21)22/h4,6-7,10,17-18H,2-3H2,1H3,(H2,20,21,22)(H3,12,13,14,19)/t4-,6-,7-,10-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	7-methylguanosine 5'-(dihydrogen phosphate)

7N0

7N0
Name:	2-[(1~{S})-2-oxidanylidenecyclopentyl]ethanoic acid
Formula:	C7 H10 O3
SMILES:	OC(=O)C[CH]1CCCC1=O
InChi:	InChI=1S/C7H10O3/c8-6-3-1-2-5(6)4-7(9)10/h5H,1-4H2,(H,9,10)/t5-/m0/s1
Definition date:	2016-11-22
Last modified:	2024-09-27
Release date:	2018-11-07
Identifier:	2-[(1~{S})-2-oxidanylidenecyclopentyl]ethanoic acid

7N4

7N4
Name:	{3-chloro-4-[(2-fluorophenyl)methoxy]phenyl}borinic acid
Formula:	C13 H11 B Cl F O2
SMILES:	B(c1cc(c(cc1)OCc2ccccc2F)Cl)O
InChi:	InChI=1S/C13H11BClFO2/c15-11-7-10(14-17)5-6-13(11)18-8-9-3-1-2-4-12(9)16/h1-7,14,17H,8H2
Definition date:	2016-11-21
Last modified:	2024-09-27
Release date:	2017-12-06
Identifier:	{3-chloro-4-[(2-fluorophenyl)methoxy]phenyl}borinic acid

7N7

7N7
Name:	naphthalen-2-ylboronic acid
Formula:	C10 H9 B O2
SMILES:	c1c2c(cc(B(O)O)c1)cccc2
InChi:	InChI=1S/C10H9BO2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7,12-13H
Definition date:	2016-11-21
Last modified:	2024-09-27
Release date:	2017-12-06
Identifier:	naphthalen-2-ylboronic acid

7N8

7N8
Name:	4-Borono-L-phenylalanine
Formula:	C9 H12 B N O4
SMILES:	N[CH](Cc1ccc(cc1)B(O)O)C(O)=O
InChi:	InChI=1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:	2016-11-24
Last modified:	2024-09-27
Release date:	2017-10-11
Identifier:	(2~{S})-2-azanyl-3-[4-(dihydroxyboranyl)phenyl]propanoic acid

7ND

7ND
Name:	(3-bromo-5-phenoxyphenyl)boronic acid
Formula:	C12 H10 B Br O3
SMILES:	Brc1cc(cc(c1)B(O)O)Oc2ccccc2
InChi:	InChI=1S/C12H10BBrO3/c14-10-6-9(13(15)16)7-12(8-10)17-11-4-2-1-3-5-11/h1-8,15-16H
Definition date:	2016-11-21
Last modified:	2024-09-27
Release date:	2017-12-06
Identifier:	(3-bromo-5-phenoxyphenyl)boronic acid

7NF

7NF
Name:	2-ethoxycarbonyl-1,3-thiazole-4-carboxylic acid
Formula:	C7 H7 N O4 S
SMILES:	CCOC(=O)c1scc(n1)C(O)=O
InChi:	InChI=1S/C7H7NO4S/c1-2-12-7(11)5-8-4(3-13-5)6(9)10/h3H,2H2,1H3,(H,9,10)
Definition date:	2016-11-27
Last modified:	2024-09-27
Release date:	2017-12-20
Identifier:	2-ethoxycarbonyl-1,3-thiazole-4-carboxylic acid

7NP

7NP
Name:	(2S)-7-methoxy-2-methyl-3,4-dihydronaphthalen-1(2H)-one
Formula:	C12 H14 O2
SMILES:	O=C2c1c(ccc(OC)c1)CCC2C
InChi:	InChI=1S/C12H14O2/c1-8-3-4-9-5-6-10(14-2)7-11(9)12(8)13/h5-8H,3-4H2,1-2H3/t8-/m0/s1
Synonyms:	Bound form of 7-METHOXY-2-(PIPERIDIN-1-YLMETHYL)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE HYDROCHLORDIDE
Definition date:	2014-06-09
Last modified:	2024-09-27
Release date:	2014-07-23
Identifier:	(2S)-7-methoxy-2-methyl-3,4-dihydronaphthalen-1(2H)-one

7NQ

7NQ
Name:	~{N}-(4-ethoxyquinazolin-2-yl)propanamide
Formula:	C13 H15 N3 O2
SMILES:	CCOc1nc(NC(=O)CC)nc2ccccc12
InChi:	InChI=1S/C13H15N3O2/c1-3-11(17)15-13-14-10-8-6-5-7-9(10)12(16-13)18-4-2/h5-8H,3-4H2,1-2H3,(H,14,15,16,17)
Definition date:	2016-11-28
Last modified:	2024-09-27
Release date:	2017-11-01
Identifier:	~{N}-(4-ethoxyquinazolin-2-yl)propanamide

7NS

7NS
Name:	[3-bromo-5-(pyrrolidin-1-yl)phenyl]borinic acid
Formula:	C10 H13 B Br N O
SMILES:	Brc1cc(BO)cc(c1)N2CCCC2
InChi:	InChI=1S/C10H13BBrNO/c12-9-5-8(11-14)6-10(7-9)13-3-1-2-4-13/h5-7,11,14H,1-4H2
Definition date:	2016-11-21
Last modified:	2024-09-27
Release date:	2017-12-06
Identifier:	[3-bromo-5-(pyrrolidin-1-yl)phenyl]borinic acid

7NW

7NW
Name:	2-methyl-1,3-thiazole-4-carboxylic acid
Formula:	C5 H5 N O2 S
SMILES:	Cc1scc(n1)C(O)=O
InChi:	InChI=1S/C5H5NO2S/c1-3-6-4(2-9-3)5(7)8/h2H,1H3,(H,7,8)
Definition date:	2016-11-29
Last modified:	2024-09-27
Release date:	2017-12-20
Identifier:	2-methyl-1,3-thiazole-4-carboxylic acid

7NX

7NX
Name:	cyclohexylmethyl hydrogen carbonate
Formula:	C8 H14 O3
SMILES:	OC(=O)OCC1CCCCC1
InChi:	InChI=1S/C8H14O3/c9-8(10)11-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)
Definition date:	2016-11-29
Last modified:	2024-09-27
Release date:	2017-12-20
Identifier:	cyclohexylmethyl hydrogen carbonate

7O3

7O3
Name:	2-chloranyl-~{N}-[4-[(2-chloranyl-5-oxidanyl-phenyl)amino]quinazolin-7-yl]ethanamide
Formula:	C16 H12 Cl2 N4 O2
SMILES:	Oc1ccc(Cl)c(Nc2ncnc3cc(NC(=O)CCl)ccc23)c1
InChi:	InChI=1S/C16H12Cl2N4O2/c17-7-15(24)21-9-1-3-11-13(5-9)19-8-20-16(11)22-14-6-10(23)2-4-12(14)18/h1-6,8,23H,7H2,(H,21,24)(H,19,20,22)
Definition date:	2016-12-01
Last modified:	2024-09-27
Release date:	2017-05-17
Identifier:	2-chloranyl-~{N}-[4-[(2-chloranyl-5-oxidanyl-phenyl)amino]quinazolin-7-yl]ethanamide

7O5

7O5
Name:	(2~{S})-2-azanyl-3-(2-sulfanylethanoylamino)propanoic acid
Formula:	C5 H10 N2 O3 S
SMILES:	N[CH](CNC(=O)CS)C(O)=O
InChi:	InChI=1S/C5H10N2O3S/c6-3(5(9)10)1-7-4(8)2-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
Definition date:	2016-12-01
Last modified:	2024-09-27
Release date:	2020-05-27
Identifier:	(2~{S})-2-azanyl-3-(2-sulfanylethanoylamino)propanoic acid

7OZ

7OZ
Name:	(S)-2-amino-4-fluorobutanoic acid
Formula:	C4 H8 F N O2
SMILES:	N[CH](CCF)C(O)=O
InChi:	InChI=1S/C4H8FNO2/c5-2-1-3(6)4(7)8/h3H,1-2,6H2,(H,7,8)/t3-/m0/s1
Synonyms:	(2S)-2-azanyl-4-fluoranyl-butanoic acid
Definition date:	2021-08-16
Last modified:	2024-09-27
Release date:	2022-03-09
Identifier:	(2~{S})-2-azanyl-4-fluoranyl-butanoic acid

7P6

7P6
Name:	[(2R,3S,4R,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate
Formula:	C6 H13 O8 P
SMILES:	O[CH]1CO[CH](CO[P](O)(O)=O)[CH](O)[CH]1O
InChi:	InChI=1S/C6H13O8P/c7-3-1-13-4(6(9)5(3)8)2-14-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5-,6-/m1/s1
Definition date:	2023-03-02
Last modified:	2024-09-27
Release date:	2024-10-02
Identifier:	[(2~{R},3~{S},4~{R},5~{R})-3,4,5-tris(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate

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