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 10 results

Search term: VBKXJHTXPSWJEN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2029590

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3
C27H40O2396.6053000000018700
2029640

1 of 8 defined stereocentres - 1/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20?,21?,22?,23?,24?,25?,26?,27-/m0/s1
C27H40O2396.6053000000015400
10042236

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21-,22+,23-,24+,25+,26+,27+/m0/s1
C27H40O2396.60532100
10042237

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21-,22+,23-,24+,25-,26+,27+/m0/s1
C27H40O2396.60532100
10042238

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21+,22+,23-,24+,25+,26+,27+/m0/s1
C27H40O2396.60532100
10042239

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21+,22+,23-,24+,25-,26+,27+/m0/s1
C27H40O2396.60532100
10042388

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21-,22+,23-,24+,25+,26+,27-/m0/s1
C27H40O2396.60532100
10042389

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21-,22+,23-,24+,25-,26+,27-/m0/s1
C27H40O2396.60532100
10042390

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21+,22+,23-,24+,25+,26+,27-/m0/s1
C27H40O2396.60532100
10042391

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H40O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,20-24,28-29H,8-18H2,1-2H3/t20-,21+,22+,23-,24+,25-,26+,27-/m0/s1
C27H40O2396.60532100

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