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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
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Found 126 results

Search term: C27H38O6 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
84007

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H38O6/c1-24(2,3)14-22(31)33-15-21(30)27(32)11-9-19-18-7-6-16-12-17(28)8-10-25(16,4)23(18)20(29)13-26(19,27)5/h8,10,12,18-20,23,29,32H,6-7,9,11,13-15H2,1-5H3/t18-,19-,20-,23+,25-,26-,27-/m0/s1
C27H38O6458.587504900
16738091

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H38O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h14-16,18,28H,7-13H2,1-6H3,(H,32,33)/t14-,15-,16+,18+,25+,26-,27+/m1/s1
C27H38O6458.587222000
136723

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H38O6/c1-4-5-6-7-23(31)33-16-22(30)27(32)13-11-20-19-9-8-17-14-18(28)10-12-25(17,2)24(19)21(29)15-26(20,27)3/h10,12,14,19-21,24,29,32H,4-9,11,13,15-16H2,1-3H3/t19-,20-,21-,24+,25-,26-,27-/m0/s1
C27H38O6458.587181900
2977886
InChI=1/C27H38O6/c1-25(2)9-17(28)15(18(29)10-25)7-8-16(23-19(30)11-26(3,4)12-20(23)31)24-21(32)13-27(5,6)14-22(24)33/h15-16,23-24H,7-14H2,1-6H3
C27H38O6458.5870213900
57583066

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H38O6/c1-23(2)16-11-14(28)22-21(24(16,3)9-7-18(23)30)15(29)13-25(4)17(12-19(31)27(22,25)6)26(5)10-8-20(32)33-26/h14,16-18,28,30H,7-13H2,1-6H3/t14-,16-,17-,18-,24-,25+,26+,27-/m0/s1
C27H38O6458.5879700
4206196

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H38O6/c1-16(6-11-24(29)31-4)20-9-10-21-19-8-7-17-14-18(33-25(30)32-5)12-13-26(17,2)22(19)15-23(28)27(20,21)3/h8,10,16-18,20,22H,6-7,9,11-15H2,1-5H3
C27H38O6458.587026300
137547

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H38O6/c1-2-3-4-5-6-7-8-9-10-11-14-32-26-18-21-23(30)16-20(28)17-25(21)33-27(26)19-12-13-22(29)24(31)15-19/h12-13,15-17,26-31H,2-11,14,18H2,1H3/t26-,27+/m0/s1
C27H38O6458.5876600
197087

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H38O6/c1-25-11-9-18(28)13-17(25)7-8-19-20-10-12-27(32,26(20,2)14-21(29)23(19)25)22(30)15-33-24(31)16-5-3-4-6-16/h13,16,19-21,23,29,32H,3-12,14-15H2,1-2H3/t19-,20-,21-,23+,25-,26-,27-/m0/s1
C27H38O6458.5875400
4729

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H38O6/c1-24(2,3)14-22(31)33-15-21(30)27(32)11-9-19-18-7-6-16-12-17(28)8-10-25(16,4)23(18)20(29)13-26(19,27)5/h8,10,12,18-20,23,29,32H,6-7,9,11,13-15H2,1-5H3
C27H38O6458.5875300
57257132

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C27H38O6/c1-23(2)16-11-14(28)22-21(24(16,3)9-7-18(23)30)15(29)13-25(4)17(12-19(31)27(22,25)6)26(5)10-8-20(32)33-26/h14,16-18,28,30H,7-13H2,1-6H3/t14-,16?,17-,18-,24-,25+,26+,27-/m0/s1
C27H38O6458.5875300
17343550

Double-bond stereo

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C27H38O6/c1-17(2)27(14-7-9-19(27)4)15-13-18(3)8-6-10-21-11-12-23(32-25(21)30)22-16-24(29)33-26(22)31-20(5)28/h8,11,16,19,23,25-26,30H,1,6-7,9-10,12-15H2,2-5H3/b18-8+/t19-,23?,25?,26?,27+/m1/s1
C27H38O6458.5874400
8894051

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C27H38O6/c1-7-8-25(31)33-24(14-27(6)18(4)10-12-22(29)19(27)5)16(2)9-11-20-23(30)13-17(3)21(15-28)26(20)32/h9,13,15,18-19,24,30,32H,7-8,10-12,14H2,1-6H3/b16-9+/t18-,19+,24-,27+/m1/s1
C27H38O6458.5874300
9560508

Double-bond stereo

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C27H38O6/c1-17(11-13-22-18(2)9-7-15-27(22,4)5)8-6-10-20-12-14-23(32-25(20)30)21-16-24(29)33-26(21)31-19(3)28/h8,12,16,23,25-26,30H,6-7,9-11,13-15H2,1-5H3/b17-8+/t23-,25?,26?/m1/s1
C27H38O6458.5874300
77840
InChI=1/C27H38O6/c1-2-3-4-11-18-31-26(29)23-17-16-20(25(28)32-21-12-7-5-8-13-21)19-24(23)27(30)33-22-14-9-6-10-15-22/h16-17,19,21-22H,2-15,18H2,1H3
C27H38O6458.5874400
3529332

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H38O6/c1-4-5-6-7-23(31)33-16-22(30)27(32)13-11-20-19-9-8-17-14-18(28)10-12-25(17,2)24(19)21(29)15-26(20,27)3/h14,19-20,24,32H,4-13,15-16H2,1-3H3
C27H38O6458.587024300
2496804

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H38O6/c1-25-11-9-18(28)13-17(25)7-8-19-20-10-12-27(32,26(20,2)14-21(29)23(19)25)22(30)15-33-24(31)16-5-3-4-6-16/h13,16,19-21,23,29,32H,3-12,14-15H2,1-2H3
C27H38O6458.5874400
10150585

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H38O6/c1-5-26(6-2)31-17-24(3,33-26)23-12-13-25(15-22-21(28)11-14-27(23,25)32-22)18-30-16-19-7-9-20(29-4)10-8-19/h7-10,22-23H,5-6,11-18H2,1-4H3/t22-,23+,24-,25+,27+/m1/s1
C27H38O6458.5873200
10150586

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H38O6/c1-5-26(6-2)31-17-24(3,33-26)23-12-13-25(15-22-21(28)11-14-27(23,25)32-22)18-30-16-19-7-9-20(29-4)10-8-19/h7-10,22-23H,5-6,11-18H2,1-4H3/t22-,23-,24+,25+,27+/m0/s1
C27H38O6458.5873200
10267651

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C27H38O6/c1-17(28)32-20(19-15-23(29)31-16-19)9-7-18-8-10-22-26(4)13-6-12-25(2,3)21(26)11-14-27(22,5)33-24(18)30/h7,15,20-22H,6,8-14,16H2,1-5H3/b18-7-/t20?,21-,22+,26-,27+/m0/s1
C27H38O6458.5873300
17343551

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H38O6/c1-18(11-13-23-19(2)9-7-15-27(23,4)5)8-6-10-21(17-28)12-14-24(30)22-16-25(31)33-26(22)32-20(3)29/h8,12,16-17,24,26,30H,6-7,9-11,13-15H2,1-5H3/b18-8+,21-12+
C27H38O6458.5873300
12345

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