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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 19 results

Search term: NRHMKIHPTBHXPF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2016726

Charge

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-;/m1./s1
C24H39NaO5430.5532521611186129
18665970

Charge

8 of 11 defined stereocentres - 8/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17?,18?,19-,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321182100
9299

Charge

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1
C24H39NaO5430.553237600
17466596

Charge

10 of 11 defined stereocentres - 10/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17+,18?,19-,20+,22+,23+,24-;/m1./s1
C24H39NaO5430.55327400
29273454

Charge

7 of 11 defined stereocentres - 7/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14?,15?,16-,17+,18+,19?,20?,22+,23+,24-;/m1./s1
C24H39NaO5430.55324100
34947502

Charge

6 of 11 defined stereocentres - 6/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14?,15-,16-,17?,18?,19+,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321100
58817104

Charge

10 of 11 defined stereocentres - 10/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23?,24-;/m1./s1
C24H39NaO5430.55321100
58817105

Charge

9 of 11 defined stereocentres - 9/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23?,24?;/m1./s1
C24H39NaO5430.55321100
66424936

Charge

9 of 11 defined stereocentres - 9/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14?,15-,16-,17+,18+,19-,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321600
78430895

Charge

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14-,15-,16-,17+,18+,19-,20+,22+,23+,24+;/m1./s1
C24H39NaO5430.55321100
78431670

Charge

3 of 11 defined stereocentres - 3/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14-,15?,16?,17?,18?,19?,20?,22?,23+,24-;/m1./s1
C24H39NaO5430.55321100
78432447

Charge

7 of 11 defined stereocentres - 7/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17?,18?,19?,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321100
78432652

Charge

2 of 11 defined stereocentres - 2/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14?,15?,16?,17?,18?,19?,20?,22?,23-,24+;/m0./s1
C24H39NaO5430.55321100
78432714

Charge

4 of 11 defined stereocentres - 4/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14?,15-,16?,17?,18?,19?,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321100
113630559

Charge

10 of 11 defined stereocentres - 10/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,15-,16-,17+,18?,19-,20+,22+,23+,24-;/m0./s1
C24H39NaO5430.55321100
122905808

Charge

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14-,15-,16-,17-,18-,19-,20-,22-,23-,24-;/m0./s1
C24H39NaO5430.55321100
7978532

Charge

9 of 11 defined stereocentres - 9/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14?,15-,16-,17+,18+,19-,20+,22+,23+,24-;/m1./s1
C24H39NaO5430.55321100
8356626

Charge

5 of 11 defined stereocentres - 5/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14-,15+,16+,17?,18?,19-,20-,22?,23?,24?;/m0./s1
C24H39NaO5430.55321100
24767626

Charge

5 of 11 defined stereocentres - 5/11 defined
InChI=1/C24H40O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13?,14?,15-,16?,17?,18?,19-,20+,22?,23+,24-;/m1./s1
C24H39NaO5430.55321100

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