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 17 results

Search term: XJIILRFVONGQOG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
107751

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15+,16-,17+,20+,21-,22+,23-/m0/s1
C23H32O7420.496211400
22938252

2 of 8 defined stereocentres - 2/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14?,15?,16-,17+,20?,21?,22?,23?/m0/s1
C23H32O7420.4964200
10046910

Charge

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1/t14-,15+,16-,17+,20+,21-,22+,23-/m0/s1
C23H31O7419.48863100
2796172

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)
C23H32O7420.495982100
10049111

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15-,16-,17-,20+,21+,22+,23+/m0/s1
C23H32O7420.4962100
10049113

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15-,16-,17+,20+,21+,22+,23+/m0/s1
C23H32O7420.4962100
22890298

1 of 8 defined stereocentres - 1/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14?,15-,16?,17?,20?,21?,22?,23?/m0/s1
C23H32O7420.4962100
10049115

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15-,16-,17-,20+,21+,22+,23-/m0/s1
C23H32O7420.4962100
10049117

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15-,16-,17+,20+,21+,22+,23-/m0/s1
C23H32O7420.4962100
17463759

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14?,15-,16-,17?,20+,21?,22+,23?/m0/s1
C23H32O7420.4961100
21470604

3 of 8 defined stereocentres - 3/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14?,15?,16-,17+,20?,21?,22-,23?/m1/s1
C23H32O7420.4961100
10049116

Charge

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1/t14-,15-,16-,17+,20+,21+,22+,23-/m0/s1
C23H31O7419.48861100
113598717

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/t14-,15+,16-,17+,20+,21-,22+,23-/m1/s1
C23H32O7420.4961100
10049114

Charge

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1/t14-,15-,16-,17-,20+,21+,22+,23-/m0/s1
C23H31O7419.48861100
10049112

Charge

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1/t14-,15-,16-,17+,20+,21+,22+,23+/m0/s1
C23H31O7419.48861100
2964509

Charge

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1
C23H31O7419.488041100
10049110

Charge

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C23H32O7/c1-20-6-3-16-17(23(20,29)9-5-15(20)13-10-18(25)30-12-13)4-7-21(28)11-14(24)2-8-22(16,21)19(26)27/h10,14-17,24,28-29H,2-9,11-12H2,1H3,(H,26,27)/p-1/t14-,15-,16-,17-,20+,21+,22+,23+/m0/s1
C23H31O7419.48861100

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