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 8 results

Search term: YCRWRXLGZMMTJD (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9125803

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16-,17-,18+,20+,21-,22+,23+,24+,25-,26-,27+,28+,29+/m1/s1
C29H46O4458.67316500
23231252

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16-,17-,18-,20+,21-,22+,23+,24+,25-,26-,27+,28+,29+/m1/s1
C29H46O4458.67312200
7979973

0 of 13 defined stereocentres - 0/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3
C29H46O4458.67312100
7979974

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16?,17-,18-,20+,21+,22+,23+,24+,25-,26-,27+,28+,29+/m1/s1
C29H46O4458.67312100
8044491

2 of 13 defined stereocentres - 2/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16?,17?,18?,20?,21?,22?,23?,24?,25?,26?,27-,28-,29?/m0/s1
C29H46O4458.67312100
8109501

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16-,17-,18+,20+,21+,22+,23+,24+,25-,26-,27+,28+,29+/m1/s1
C29H46O4458.67312100
8429133

10 of 13 defined stereocentres - 10/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16-,17-,18+,20?,21+,22?,23?,24+,25-,26-,27+,28+,29+/m1/s1
C29H46O4458.67312100
8587295

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C29H46O4/c1-16-11-21(16)17(2)12-26(32)29(15-33-29)24-8-7-22-20-6-5-18-13-19(30)9-10-27(18,3)23(20)14-25(31)28(22,24)4/h16-18,20-26,31-32H,5-15H2,1-4H3/t16-,17+,18+,20-,21-,22-,23?,24-,25+,26+,27-,28-,29-/m0/s1
C29H46O4458.67312100

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