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 7 results

Search term: SSMKLDJJCIRAMZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
22875509

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C26H39N3O7/c1-16(30)21(24(33)34)29-22(31)19-12-10-18(11-13-19)15-27-23(32)20(14-17-8-6-5-7-9-17)28-25(35)36-26(2,3)4/h5-9,16,18-21,30H,10-15H2,1-4H3,(H,27,32)(H,28,35)(H,29,31)(H,33,34)/t16?,18-,19-,20-,21+/m0/s1
C26H39N3O7505.603810800
22875479

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C26H39N3O7/c1-16(30)21(24(33)34)29-22(31)19-12-10-18(11-13-19)15-27-23(32)20(14-17-8-6-5-7-9-17)28-25(35)36-26(2,3)4/h5-9,16,18-21,30H,10-15H2,1-4H3,(H,27,32)(H,28,35)(H,29,31)(H,33,34)/t16?,18-,19-,20-,21-/m0/s1
C26H39N3O7505.60386500
4022640

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C26H39N3O7/c1-16(30)21(24(33)34)29-22(31)19-12-10-18(11-13-19)15-27-23(32)20(14-17-8-6-5-7-9-17)28-25(35)36-26(2,3)4/h5-9,16,18-21,30H,10-15H2,1-4H3,(H,27,32)(H,28,35)(H,29,31)(H,33,34)
C26H39N3O7505.603762100
17468672

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C26H39N3O7/c1-16(30)21(24(33)34)29-22(31)19-12-10-18(11-13-19)15-27-23(32)20(14-17-8-6-5-7-9-17)28-25(35)36-26(2,3)4/h5-9,16,18-21,30H,10-15H2,1-4H3,(H,27,32)(H,28,35)(H,29,31)(H,33,34)/t16?,18?,19?,20-,21-/m0/s1
C26H39N3O7505.60381100
17469037

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C26H39N3O7/c1-16(30)21(24(33)34)29-22(31)19-12-10-18(11-13-19)15-27-23(32)20(14-17-8-6-5-7-9-17)28-25(35)36-26(2,3)4/h5-9,16,18-21,30H,10-15H2,1-4H3,(H,27,32)(H,28,35)(H,29,31)(H,33,34)/t16?,18?,19?,20-,21+/m0/s1
C26H39N3O7505.60381100

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