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 14 results

Search term: VDZDKQBSTYNFGG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4588540

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19+,20-,21+,22-,23-,24-,25+/m0/s1
C25H40O4404.5827141500
4588707

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19-,20-,21+,22-,23-,24-,25+/m0/s1
C25H40O4404.5827121500
32700463

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19+,20-,21+,22-,23-,24-,25+/m0/s1
C25H40O4404.58278800
468614

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3
C25H40O4404.582781100
21468739

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19+,20+,21-,22+,23+,24+,25-/m1/s1
C25H40O4404.58275700
22889170

1 of 9 defined stereocentres - 1/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15?,18?,19-,20?,21?,22?,23?,24?,25?/m1/s1
C25H40O4404.58273100
9727982

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19+,20+,21?,22+,23+,24+,25-/m1/s1
C25H40O4404.58272100
9778578

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19-,20-,21?,22-,23-,24-,25+/m0/s1
C25H40O4404.58272100
9871809

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19-,20-,21?,22-,23-,24-,25+/m0/s1
C25H40O4404.58272100
62422052

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18-,19+,20+,21+,22-,23+,24-,25+/m0/s1
C25H40O4404.58272200
62579606

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19-,20-,21+,22+,23-,24+,25-/m1/s1
C25H40O4404.58272200
20037487

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15?,18-,19-,20+,21-,22+,23+,24+,25-/m1/s1
C25H40O4404.58271100
58816497

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C25H40O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h15,18-23H,6-14H2,1-5H3/t15-,18+,19+,20-,21+,22-,23-,24?,25?/m0/s1
C25H40O4404.58271100

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