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 9 results

Search term: SLDLSMFNGFIPNI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4445340

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+/t16-,17+,18-,19+,20+,21-,22+/m0/s1
C23H40O5396.5607171710
4940732

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+/t16-,17?,18-,19+,20+,21-,22+/m0/s1
C23H40O5396.56075400
7997867

Double-bond stereo

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+/t16-,17?,18?,19+,20?,21?,22?/m0/s1
C23H40O5396.56072100
8867618

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined

Non-standard isotope
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+/t16-,17+,18-,19+,20+,21-,22+/m0/s1/i19+2
C2214CH40O5398.55322100
10443986

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+
C23H40O5396.56072100
13181149

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined

Non-standard isotope
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/b8-7+/t16-,17+,18-,19-,20+,21-,22+/m0/s1/i19+2
C2214CH40O5398.55321100
67025565

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/t16-,17+,18-,19+,20+,21-,22+/m0/s1
C23H40O5396.56071100
114815503

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C23H40O5/c1-4-5-6-16(2)11-19(24)7-8-20-21-13-17(12-18(21)14-22(20)25)9-10-28-15-23(26)27-3/h7-8,16-22,24-25H,4-6,9-15H2,1-3H3/t16-,17+,18+,19+,20+,21-,22-/m0/s1
C23H40O5396.56071100

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