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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 11 results

Search term: URGUBECARCAPRI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21256369

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17-,18-,19+,21+,22-/m1/s1
C22H27NO7417.45235500
26231493

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17-,18+,19+,21+,22+/m1/s1
C22H27NO7417.45234464
28504697

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17-,18+,19?,21+,22+/m1/s1
C22H27NO7417.45232200
28660998

Double-bond stereo

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/t11-,12?,17?,18?,19?,21+,22?/m1/s1
C22H27NO7417.45232200
59700940

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17+,18+,19+,21+,22+/m1/s1
C22H27NO7417.45232200
24662786

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17-,18+,19-,21-,22+/m1/s1
C22H27NO7417.45232200
66424464

Double-bond stereo

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13-/t11?,12-,17+,18+,19+,21?,22+/m1/s1
C22H27NO7417.45231200
23110455

Double-bond stereo

3 of 7 defined stereocentres - 3/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13-/t11-,12?,17?,18?,19+,21+,22?/m1/s1
C22H27NO7417.45231100
23354372

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13-/t11-,12-,17-,18+,19+,21+,22+/m1/s1
C22H27NO7417.45231100
57257227

Double-bond stereo

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12?,17?,18?,19?,21+,22?/m1/s1
C22H27NO7417.45231100
57578643

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8u,15-13u/t11-,12-,17-,18?,19+,21+,22+/m1/s1
C22H27NO7417.45231100

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