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 10 results

Search term: NFVZMTPMHRVCTP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2035093

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/t18?,19?,20?,23-,24-,25-/m0/s1
C25H34O3382.535666400
2768820

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)
C25H34O3382.535663200
10043116

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/t18-,19+,20-,23+,24+,25+/m1/s1
C25H34O3382.53572100
10043118

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/t18-,19-,20+,23-,24-,25-/m0/s1
C25H34O3382.53572100
10043120

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/t18-,19-,20-,23+,24+,25+/m1/s1
C25H34O3382.53572100
10043121

Charge

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/p-1/t18-,19+,20+,23-,24-,25-/m0/s1
C25H33O3381.52832200
10043122

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/t18-,19+,20+,23-,24-,25-/m0/s1
C25H34O3382.53572100
10043119

Charge

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/p-1/t18-,19-,20-,23+,24+,25+/m1/s1
C25H33O3381.52831100
10043117

Charge

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/p-1/t18-,19-,20+,23-,24-,25-/m0/s1
C25H33O3381.52831100
10043115

Charge

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C25H34O3/c1-6-25(28)14-11-20-18-8-7-17-15-16(22(2,3)21(26)27)9-12-23(17,4)19(18)10-13-24(20,25)5/h1,7,15,18-20,28H,8-14H2,2-5H3,(H,26,27)/p-1/t18-,19+,20-,23+,24+,25+/m1/s1
C25H33O3381.52831100

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