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 2 results

Search term: MYGUHKJYIWIXNI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9630652

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C36H42N4O2/c41-29-13-10-12-25-26-15-18-37-32(33(26)38-31(25)29)27-22-36-17-8-3-1-2-4-9-19-39-20-16-28(27)35(23-39)21-24-11-6-5-7-14-30(42-36)40(24)34(35)36/h1,3,6,10-13,15,18,22,24,28,30,34,38,41H,2,4-5,7-9,14,16-17,19-21,23H2/b3-1-,11-6-/t24-,28-,30+,34+,35-,36-/m0/s1
C36H42N4O2562.74435400
34981613

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C36H42N4O2/c41-29-13-10-12-25-26-15-18-37-32(33(26)38-31(25)29)27-22-36-17-8-3-1-2-4-9-19-39-20-16-28(27)35(23-39)21-24-11-6-5-7-14-30(42-36)40(24)34(35)36/h1,3,6,10-13,15,18,22,24,28,30,34,38,41H,2,4-5,7-9,14,16-17,19-21,23H2/b3-1-,11-6-/t24-,28-,30+,34+,35+,36-/m0/s1
C36H42N4O2562.74432200

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