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
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Found 5 results

Search term: TXEVVAPERSDMTN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8493348

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H36O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6-,18-9-/t17-,19+,20-,21-,23-,24+,25+/m0/s1
C25H36O3384.55156500
29213368

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H36O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6-,18-9-/t17-,19+,20-,21-,23+,24+,25+/m0/s1
C25H36O3384.55153300
8244158

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C25H36O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6+,18-9-/t17-,19+,20-,21-,23+,24+,25+/m0/s1
C25H36O3384.55152100
78436186

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C25H36O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6-,18-9-/t17-,19?,20-,21-,23-,24+,25+/m0/s1
C25H36O3384.55151100
78436209

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C25H36O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6-,18-9-/t17-,19?,20-,21-,23+,24+,25+/m0/s1
C25H36O3384.55151100

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