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substances: 259549

This data as json

inchi_id inchi inchikey
259549 InChI=1S/C66H104N18O16S/c1-9-35(6)52(83-58(93)42(22-23-50(86)87)74-59(94)43(26-34(4)5)76-63(98)48-32-101-66(81-48)84-54(69)37(8)11-3)64(99)75-40-20-15-16-25-71-55(90)46(29-49(68)85)78-62(97)47(30-51(88)89)79-61(96)45(28-39-31-70-33-72-39)77-60(95)44(27-38-18-13-12-14-19-38)80-65(100)53(36(7)10-2)82-57(92)41(21-17-24-67)73-56(40)91/h12-14,18-19,31,33-37,40-48,52-54H,9-11,15-17,20-30,32,67,69H2,1-8H3,(H2,68,85)(H,70,72)(H,71,90)(H,73,91)(H,74,94)(H,75,99)(H,76,98)(H,77,95)(H,78,97)(H,79,96)(H,80,100)(H,81,84)(H,82,92)(H,83,93)(H,86,87)(H,88,89)/t35?,36?,37?,40-,41+,42+,43-,44+,45-,46-,47+,48?,52-,53-,54?/m0/s1 ADQCOQJMTUAWAR-XDEZYTCSSA-N

Links from other tables

  • 3 rows from inchi_id in api_results
  • 0 rows from inchi_id in cleanventory_chemicals
  • 8 rows from inchi_id in consensus_index
  • 0 rows from inchi_id in zeropm_chemicals
  • 0 rows from inchi_id in components
  • 0 rows from inchi_id in multi_components
  • 0 rows from inchi_id in pm_probabilities
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