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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
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Found 9 results

Search term: C26H32N2O11 (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
29277426

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C24H30N2O7.C2H2O4/c1-27-19-6-5-15(9-20(19)28-2)7-8-25-13-17-12-18(33-26-17)10-16-11-21(29-3)23-24(22(16)30-4)32-14-31-23;3-1(4)2(5)6/h5-6,9,11,18,25H,7-8,10,12-14H2,1-4H3;(H,3,4)(H,5,6)
C26H32N2O11548.53916400
17250253

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C26H32N2O11/c1-2-12-13-9-18(30)28(8-7-26(36)15-5-3-4-6-16(15)27-25(26)35)22(34)14(13)11-37-23(12)39-24-21(33)20(32)19(31)17(10-29)38-24/h2-6,11-13,17-21,23-24,29-33,36H,1,7-10H2,(H,27,35)/t12-,13+,17-,18-,19-,20+,21-,23+,24+,26+/m1/s1
C26H32N2O11548.53913300
23139252

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H32N2O11/c1-8-12-35-28-25(32)38-21-19(30)24(39-26(5,6)22(21)33-7)36-16-11-10-15-18(29)17(14(4)27-34-9-2)23(31)37-20(15)13(16)3/h1,10-11,19,21-22,24,30-31H,9,12H2,2-7H3,(H,28,32)/b27-14+/t19-,21+,22-,24-/m1/s1
C26H32N2O11548.53912200
23141425

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H32N2O11/c1-8-12-35-28-25(32)38-21-19(30)24(39-26(5,9-2)22(21)33-6)36-16-11-10-15-18(29)17(14(4)27-34-7)23(31)37-20(15)13(16)3/h1,10-11,19,21-22,24,29-30H,9,12H2,2-7H3,(H,28,32)/b27-14+/t19-,21+,22-,24-,26+/m1/s1
C26H32N2O11548.53912200
8047904

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C26H32N2O11/c1-8-11-35-28-25(33)38-20-18(30)24(39-26(5,6)21(20)34-7)36-15-10-9-14-17(29)16(27-22(31)12(2)3)23(32)37-19(14)13(15)4/h1,9-10,12,18,20-21,24,30,32H,11H2,2-7H3,(H,27,31)(H,28,33)/t18-,20+,21-,24-/m1/s1
C26H32N2O11548.53912100
8091128

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C26H32N2O11/c1-8-12-35-28-25(32)38-21-19(30)24(39-26(5,9-2)22(21)33-6)36-16-11-10-15-18(29)17(14(4)27-34-7)23(31)37-20(15)13(16)3/h1,10-11,19,21-22,24,27,30H,9,12H2,2-7H3,(H,28,32)/b17-14-
C26H32N2O11548.53912100
8134792

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C26H32N2O11/c1-8-12-35-28-25(32)38-21-19(30)24(39-26(5,6)22(21)33-7)36-16-11-10-15-18(29)17(14(4)27-34-9-2)23(31)37-20(15)13(16)3/h1,10-11,19,21-22,24,27,30H,9,12H2,2-7H3,(H,28,32)/b17-14-
C26H32N2O11548.53912100
9459229

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H32N2O11/c1-13(29)35-12-19-21(36-14(2)30)22(37-15(3)31)20(18(38-19)11-27-25(34)39-26(4,5)6)28-23(32)16-9-7-8-10-17(16)24(28)33/h7-10,18-22H,11-12H2,1-6H3,(H,27,34)/t18-,19+,20-,21+,22+/m0/s1
C26H32N2O11548.53912100
57427267

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C26H32N2O11/c1-6-9-27-26(33)28-22-24(36-16(5)31)23(35-15(4)30)20(12-34-14(3)29)39-25(22)37-17-7-8-18-13(2)10-21(32)38-19(18)11-17/h7-8,10-11,20,22-25H,6,9,12H2,1-5H3,(H2,27,28,33)/t20-,22-,23-,24-,25-/m1/s1
C26H32N2O11548.53911100

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