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: CHWMTSYJQGXKSR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4585272

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3-,6-4-
C27H34O10518.55294500
24660479

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3+,6-4-/t16-,18-,19-,20-,23+,25-,26-,27+/m1/s1
C27H34O10518.55294400
57262398

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3-,6-4-/t16-,18-,19-,20-,23+,25-,26-,27+/m1/s1
C27H34O10518.55293100
21257931

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3+,6-4+
C27H34O10518.55292200
138052

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3
C27H34O10518.55292100
23171088

Double-bond stereo

5 of 8 defined stereocentres - 5/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3+,6-4-/t16?,18-,19-,20-,23?,25-,26-,27?/m1/s1
C27H34O10518.55291100
58827755

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H34O10/c1-16-8-10-33-21(29)5-3-4-6-22(30)37-18-12-20-27(15-35-27)25(18,2)26(14-34-24(32)23(16)31)9-7-17(13-28)11-19(26)36-20/h3-6,11,16,18-20,23,28,31H,7-10,12-15H2,1-2H3/b5-3+,6-4?/t16-,18-,19-,20-,23+,25-,26-,27+/m1/s1
C27H34O10518.55291200

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