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 20 results

Search term: YXZVCZUDUJEPPK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
83844

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59922925014
433364

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3
C25H42O3390.599271300
197481

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59926600
9915853

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17?,18-,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59924500
2496975

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19+,20+,21-,22-,24-,25+/m1/s1
C25H42O3390.59923300
24607939

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59923300
58783964

7 of 9 defined stereocentres - 7/9 defined

Non-standard isotope
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18+,19+,20?,21+,22?,24+,25-/m1/s1/i10D2,11D2,15D2,18D
C25H35D7O3397.64233600
58784059

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20?,21+,22+,24+,25-/m1/s1
C25H42O3390.59922500
58783155

7 of 9 defined stereocentres - 7/9 defined

Non-standard isotope
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20?,21+,22?,24+,25-/m1/s1/i10D2,11D2,15D2,18D
C25H35D7O3397.64232500
5145695

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19-,20+,21-,22-,24+,25+/m1/s1
C25H42O3390.59922100
10295381

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18+,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59922200
328877

4 of 9 defined stereocentres - 4/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16?,17-,18?,19+,20?,21?,22?,24+,25-/m1/s1
C25H42O3390.59922200
553235

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19-,20-,21-,22-,24-,25+/m0/s1
C25H42O3390.59921100
17283930

5 of 9 defined stereocentres - 5/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16?,17-,18-,19?,20-,21?,22?,24+,25-/m1/s1
C25H42O3390.59921100
20559220

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16?,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59921100
58816581

7 of 9 defined stereocentres - 7/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24?,25?/m1/s1
C25H42O3390.59921100
58842749

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16?,17-,18+,19+,20+,21-,22-,24+,25-/m1/s1
C25H42O3390.59921100
66425132

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18-,19-,20-,21+,22+,24+,25-/m1/s1
C25H42O3390.59921100
78273018

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m0/s1
C25H42O3390.59921100

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