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 6 results

Search term: LIHGUQHVXVXRJZ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2374922

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3
C33H31NO5521.60294161200
10055491

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3/t26?,27?,28-,29-,30-/m0/s1
C33H31NO5521.60293200
5466625

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3/t26?,27?,28-,29+,30-/m1/s1
C33H31NO5521.60292100
5466626

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3/t26?,27?,28-,29+,30-/m0/s1
C33H31NO5521.60292100
10055490

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3/t26?,27?,28-,29-,30+/m0/s1
C33H31NO5521.60292100
62606926

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C33H31NO5/c1-17(2)30(33(38)39-16-25(35)24-15-18(3)13-14-19(24)4)34-31(36)28-26-20-9-5-6-10-21(20)27(29(28)32(34)37)23-12-8-7-11-22(23)26/h5-15,17,26-30H,16H2,1-4H3/t26-,27+,28-,29-,30-/m0/s1
C33H31NO5521.60291100

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