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 5 results

Search term: GDYPYMRZUSWASH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2373166

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C31H41N5O5/c1-19(2)15-25(28(38)34-24(27(32)37)16-20-11-7-6-8-12-20)35-29(39)26(36-30(40)41-31(3,4)5)17-21-18-33-23-14-10-9-13-22(21)23/h6-14,18-19,24-26,33H,15-17H2,1-5H3,(H2,32,37)(H,34,38)(H,35,39)(H,36,40)
C31H41N5O5563.6877399999986200
6202098

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H41N5O5/c1-19(2)15-25(28(38)34-24(27(32)37)16-20-11-7-6-8-12-20)35-29(39)26(36-30(40)41-31(3,4)5)17-21-18-33-23-14-10-9-13-22(21)23/h6-14,18-19,24-26,33H,15-17H2,1-5H3,(H2,32,37)(H,34,38)(H,35,39)(H,36,40)/t24-,25-,26+/m0/s1
C31H41N5O5563.68772100
6202099

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H41N5O5/c1-19(2)15-25(28(38)34-24(27(32)37)16-20-11-7-6-8-12-20)35-29(39)26(36-30(40)41-31(3,4)5)17-21-18-33-23-14-10-9-13-22(21)23/h6-14,18-19,24-26,33H,15-17H2,1-5H3,(H2,32,37)(H,34,38)(H,35,39)(H,36,40)/t24-,25+,26-/m1/s1
C31H41N5O5563.68772100
6216703

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H41N5O5/c1-19(2)15-25(28(38)34-24(27(32)37)16-20-11-7-6-8-12-20)35-29(39)26(36-30(40)41-31(3,4)5)17-21-18-33-23-14-10-9-13-22(21)23/h6-14,18-19,24-26,33H,15-17H2,1-5H3,(H2,32,37)(H,34,38)(H,35,39)(H,36,40)/t24-,25+,26+/m0/s1
C31H41N5O5563.68772100
6216704

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H41N5O5/c1-19(2)15-25(28(38)34-24(27(32)37)16-20-11-7-6-8-12-20)35-29(39)26(36-30(40)41-31(3,4)5)17-21-18-33-23-14-10-9-13-22(21)23/h6-14,18-19,24-26,33H,15-17H2,1-5H3,(H2,32,37)(H,34,38)(H,35,39)(H,36,40)/t24-,25-,26-/m1/s1
C31H41N5O5563.68772100

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