Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 3 results

Search term: GLYNIAIEBXBHCT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
355128

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C38H63N3O6/c1-3-31-21-16-17-25-37(47-31)28-30-23-24-32-34(38(26-19-20-29(2)46-38)40-36(39-37)41(30)32)35(44)45-27-18-14-12-10-8-6-4-5-7-9-11-13-15-22-33(42)43/h16,21,29-32,34H,3-15,17-20,22-28H2,1-2H3,(H2,39,40,42,43)/p+1/t29-,30+,31+,32-,34-,37+,38-/m1/s1
C38H64N3O6658.93074200
9149692

Charge

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C38H63N3O6/c1-3-31-21-16-17-25-37(47-31)28-30-23-24-32-34(38(26-19-20-29(2)46-38)40-36(39-37)41(30)32)35(44)45-27-18-14-12-10-8-6-4-5-7-9-11-13-15-22-33(42)43/h16,21,29-32,34H,3-15,17-20,22-28H2,1-2H3,(H2,39,40,42,43)/p+1/t29-,30+,31+,32+,34+,37+,38+/m1/s1
C38H64N3O6658.93072200
8434276

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C38H63N3O6/c1-3-31-21-16-17-25-37(47-31)28-30-23-24-32-34(38(26-19-20-29(2)46-38)40-36(39-37)41(30)32)35(44)45-27-18-14-12-10-8-6-4-5-7-9-11-13-15-22-33(42)43/h16,21,29-32,34H,3-15,17-20,22-28H2,1-2H3,(H2,39,40,42,43)/t29-,30+,31+,32-,34-,37+,38-/m1/s1
C38H63N3O6657.92331100

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