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 11 results

Search term: IESQYBPJTJOIEI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
28536567

Double-bond stereo

6 of 8 defined stereocentres - 6/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+/t19-,20+,21?,23+,25-,26+,27+,28?/m0/s1
C28H42378.6331201300
28424520

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+/t19-,20+,21+,23+,25-,26+,27+,28-/m0/s1
C28H42378.6331161000
4515620

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+
C28H42378.6331101200
58801760

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+/t19-,20+,21-,23+,25-,26+,27+,28-/m0/s1
C28H42378.63314300
22903211

Double-bond stereo

1 of 8 defined stereocentres - 1/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7-/t19?,20?,21-,23?,25?,26?,27?,28?/m1/s1
C28H42378.63313200
4510993

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7-
C28H42378.63313200
199324

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3
C28H42378.63312100
57620380

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/t19-,20+,21+,23+,25-,26+,27+,28-/m0/s1
C28H42378.63312100
113611358

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+/t19-,20+,21-,23-,25+,26+,27-,28-/m0/s1
C28H42378.63311100
115015414

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C28H42/c1-18(2)19(3)7-8-20(4)23-9-10-24-22-12-16-28-17-21(28)11-15-27(28,6)25(22)13-14-26(23,24)5/h7-8,12,16,18-21,23,25H,9-11,13-15,17H2,1-6H3/b8-7+/t19-,20+,21+,23?,25-,26+,27+,28-/m0/s1
C28H42378.63311100

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