home / zeropm-v0-0-4 / substances

substances: 270178

This data as json

inchi_id inchi inchikey
270178 InChI=1S/C52H98N16O13.H2O4S/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75;1-5(2,3)4/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76);(H2,1,2,3,4) VEXVWZFRWNZWJX-UHFFFAOYSA-N

Links from other tables

  • 3 rows from inchi_id in api_results
  • 0 rows from inchi_id in cleanventory_chemicals
  • 10 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
Powered by Datasette · Queries took 1.489ms