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(s)-4-amino-5-((r)-1-(carboxymethylamin…
(s)-4-amino-5-((r)-1-(carboxymethylamino)-3-(2,6-dihydroxy-3-(4-oxo-2-((s)-1-(n-(pyridin-3-ylmethyl)-2-(4-(trifluoromethoxy)phenyl)acetamido)ethyl)pyrido[2,3-d]pyrimidin-3(4h)-yl)phenylthio)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
  • InChIKey: SOFCTBLAEJWBSR-AIGMYPEUSA-N
  • Compound CID: 137662331
  • Molecular Formula: C40H39F3N8O11S
(s)-4-amino-5-((r)-1-(carboxymethylamin…
(s)-4-amino-5-((r)-1-(carboxymethylamino)-3-(3,5-dihydroxy-2-(4-oxo-2-((r)-1-(n-(pyridin-3-ylmethyl)-2-(4-(trifluoromethoxy)phenyl)acetamido)ethyl)pyrido[2,3-d]pyrimidin-3(4h)-yl)phenylthio)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
  • InChIKey: MLSKLSUPBVTAAQ-MHWRTBLVSA-N
  • Compound CID: 118753518
  • Molecular Formula: C40H39F3N8O11S
(s)-4-amino-5-((r)-1-(carboxymethylamin…
(s)-4-amino-5-((r)-1-(carboxymethylamino)-3-(4,5-dihydroxy-2-(4-oxo-2-((r)-1-(n-(pyridin-3-ylmethyl)-2-(4-(trifluoromethoxy)phenyl)acetamido)ethyl)pyrido[2,3-d]pyrimidin-3(4h)-yl)phenylthio)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
  • InChIKey: XJWSYJJHWRUGNN-AIGMYPEUSA-N
  • Compound CID: 118753515
  • Molecular Formula: C40H39F3N8O11S
13-hydroxy-16,17-dimethoxy-6-(2-methylo…
13-hydroxy-16,17-dimethoxy-6-(2-methyloxiran-2-yl)-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
  • InChIKey: AFMUPHIHAGLSEN-UHFFFAOYSA-N
  • Compound CID: 154699473
  • Molecular Formula: C23H22O8
2-(hydroxymethyl)-6-[(5R,7S,10S,13R,14R…
2-(hydroxymethyl)-6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-4-oxoheptanoic acid
  • InChIKey: ZFTRNVQMRZXSKV-AJDPLLFCSA-N
  • Compound CID: 137656559
  • Molecular Formula: C30H42O8
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: IFUHVXQJFIIVGX-DQXAPYKYSA-N
  • Compound CID: 137656560
  • Molecular Formula: C30H42O8
2-hydroxy-6-[(5R,7S,10S,13R,14R,17R)-7-…
2-hydroxy-6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: ZKHZGAPANLMARS-TURBMSBNSA-N
  • Compound CID: 137656558
  • Molecular Formula: C30H42O8
6-[(5R,7S,10S,13R,14R,17R)-3,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-3,7-dihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: LWPLEHFGBRFRKI-UFEJFZICSA-N
  • Compound CID: 137656556
  • Molecular Formula: C30H44O7
6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4-…
6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: PNVINRHHAOWLTA-LUQNUPBKSA-N
  • Compound CID: 137656561
  • Molecular Formula: C30H42O8
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-(hydroxymethyl)-4-oxoheptanoic acid
  • InChIKey: BKOSGCGOQWCRKA-DQXAPYKYSA-N
  • Compound CID: 137656563
  • Molecular Formula: C30H42O9
6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,…
6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-3-sulfooxy-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: UKTSXMCLNJGRLD-JIBNASOQSA-N
  • Compound CID: 137656567
  • Molecular Formula: C30H44O10S
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-hydroxy-2-methyl-4-oxoheptanoic acid
  • InChIKey: CVHFVQATNDCTBO-LSHZHFMRSA-N
  • Compound CID: 137656562
  • Molecular Formula: C30H42O9
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: HEVGRJBCZMHZIA-ISBYAQPVSA-N
  • Compound CID: 137656565
  • Molecular Formula: C30H42O9
[(11e,13e)-10-acetyloxy-6-[5-(4-acetylo…
[(11e,13e)-10-acetyloxy-6-[5-(4-acetyloxy-5-hydroxy-4,6-dimethyl-5-propanoyloxyoxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate
  • InChIKey: WRCOPPWOVNIXRA-FNIFWQFPSA-N
  • Compound CID: 154700062
  • Molecular Formula: C45H71NO18
(2s,3s,4s,5r)-3,4,5-trihydroxy-6-[[(1s,…
(2s,3s,4s,5r)-3,4,5-trihydroxy-6-[[(1s,12s,14r)-14-hydroxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-9-yl]oxy]oxane-2-carboxylic acid
  • InChIKey: XDVUICJRQISSRL-PBTKJLNWSA-N
  • Compound CID: 154700080
  • Molecular Formula: C22H27NO9
(8s,10r,13s,14s,16r,17s)-17-[2-[4-(2,6-…
(8s,10r,13s,14s,16r,17s)-17-[2-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]acetyl]-6-hydroxy-10,13,16-trimethyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
  • InChIKey: VDRMYIRMMZPUDN-MHQDJAMUSA-N
  • Compound CID: 154700011
  • Molecular Formula: C38H52N6O3
2-hydroxy-6-[(5R,7S,10S,13R,14R,17R)-7-…
2-hydroxy-6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
  • InChIKey: INYGYBPRGVBVKJ-GQGQDMEXSA-N
  • Compound CID: 137656564
  • Molecular Formula: C30H42O9
[12-acetyloxy-15-[2,5-dihydroxy-4,4-dim…
[12-acetyloxy-15-[2,5-dihydroxy-4,4-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]oxy-1,9-dihydroxy-4-methoxycarbonyloxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
  • InChIKey: FJXCOVGJBIFUNA-UHFFFAOYSA-N
  • Compound CID: 154699592
  • Molecular Formula: C43H59NO17
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydrox…
6-[(5R,7S,10S,13R,14R,17R)-2,7-dihydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-hydroxy-2-methyl-4-oxoheptanoic acid
  • InChIKey: SKGSIAKZQNLEHL-HTAUGYGNSA-N
  • Compound CID: 137656566
  • Molecular Formula: C30H42O10
6-oxaheptacyclo[11.10.2.02,8.05,7.010,2…
6-oxaheptacyclo[11.10.2.02,8.05,7.010,24.017,25.018,23]pentacosa-1(24),2(8),3,5(7),9,11,13(25),14,16,18,20,22-dodecaene
  • InChIKey: RNWHENHYLHGYSS-UHFFFAOYSA-N
  • Compound CID: 154699930
  • Molecular Formula: C24H12O
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Funding support from the European Union’s Horizon 2020 research and innovation program under Grant Agreement No. 101036756 for project “ZeroPM: Zero pollution of persistent, mobile substances”

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