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
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Found 3136 results

Search term: C28H33N5O3 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5293351
InChI=1/C28H33N5O3/c1-30-26-24(27(34)31(2)28(30)35)33(20-29-26)17-9-16-32-18-14-23(15-19-32)36-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-8,10-13,20,23,25H,9,14-19H2,1-2H3
C28H33N5O3487.59332201700
11176924
InChI=1/C28H33N5O3/c1-28(2,3)22(34)18-33-23(29-25-24(33)26(35)31(5)27(36)30(25)4)19-32(16-20-12-8-6-9-13-20)17-21-14-10-7-11-15-21/h6-15H,16-19H2,1-5H3
C28H33N5O3487.5933181100
3515237

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C28H33N5O3/c1-30-24-23(25(34)31(2)27(30)35)33-16-22(20-4-6-21(36-3)7-5-20)32(26(33)29-24)9-8-28-13-17-10-18(14-28)12-19(11-17)15-28/h4-7,16-19H,8-15H2,1-3H3
C28H33N5O3487.59332171200
2972117

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-3-35-24-13-12-20(18-25(24)36-4-2)14-15-30-28(34)21(19-29)26-27(33-16-8-5-9-17-33)32-23-11-7-6-10-22(23)31-26/h6-7,10-13,18,21H,3-5,8-9,14-17H2,1-2H3,(H,30,34)
C28H33N5O3487.59332161000
2984126
InChI=1/C28H33N5O3/c1-3-35-22-14-13-18(17-23(22)36-4-2)15-16-33-26(29)24(28(34)30-19-9-5-6-10-19)25-27(33)32-21-12-8-7-11-20(21)31-25/h7-8,11-14,17,19H,3-6,9-10,15-16,29H2,1-2H3,(H,30,34)
C28H33N5O3487.59332151000
4470926

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H33N5O3/c1-19(20-14-16-23(34)17-15-20)32-26(35)24(13-8-18-31-28(29)30)33-27(36)25(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-7,9-12,14-17,19,24-25,34H,8,13,18H2,1H3,(H,32,35)(H,33,36)(H4,29,30,31)/t19-,24-/m1/s1
C28H33N5O3487.59332151400
21524854

Double-bond stereo
InChI=1/C28H33N5O3/c1-3-4-5-6-7-9-17-33-25(29)22(27(34)30-19-20-12-14-21(36-2)15-13-20)18-23-26(33)31-24-11-8-10-16-32(24)28(23)35/h8,10-16,18,29H,3-7,9,17,19H2,1-2H3,(H,30,34)
C28H33N5O3487.593315900
2449991

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-5-20-13-15-21(16-14-20)26(27(35)29-28(3,4)6-2)32(18-22-10-9-17-36-22)25(34)19-33-24-12-8-7-11-23(24)30-31-33/h7-17,26H,5-6,18-19H2,1-4H3,(H,29,35)
C28H33N5O3487.593315900
12521155

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C28H33N5O3/c1-27(2)13-21-14-28(3,17-27)18-32(21)19-33-23-12-8-7-11-22(23)25(26(33)35)31-30-24(34)16-36-29-15-20-9-5-4-6-10-20/h4-12,15,21H,13-14,16-19H2,1-3H3,(H,30,34)/b29-15+,31-25-
C28H33N5O3487.5933141000
13146129

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-36-26-12-6-5-8-22(26)13-15-30-27(34)28(35)31-21-25(23-9-7-14-29-20-23)33-18-16-32(17-19-33)24-10-3-2-4-11-24/h2-12,14,20,25H,13,15-19,21H2,1H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933141200
5052332
InChI=1/C28H33N5O3/c1-20-8-9-21(2)22(16-20)18-32-25-7-4-3-6-23(25)24-17-30-33(28(35)27(24)32)19-26(34)29-10-5-11-31-12-14-36-15-13-31/h3-4,6-9,16-17H,5,10-15,18-19H2,1-2H3,(H,29,34)
C28H33N5O3487.593313900
3024231
InChI=1/C28H33N5O3/c1-3-5-6-7-10-17-30-27(34)23-24-26(32-22-12-9-8-11-21(22)31-24)33(25(23)29)20-15-13-19(14-16-20)28(35)36-18-4-2/h8-9,11-16H,3-7,10,17-18,29H2,1-2H3,(H,30,34)
C28H33N5O3487.5933213900
3851615

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C28H33N5O3/c1-18-13-19(2)17-33(16-18)27-26(31-22-7-5-6-8-23(22)32-27)21(15-29)28(34)30-12-11-20-9-10-24(35-3)25(14-20)36-4/h5-10,14,18-19,21H,11-13,16-17H2,1-4H3,(H,30,34)
C28H33N5O3487.593312600
22531710
InChI=1/C28H33N5O3/c1-4-14-31-26(35)23-13-12-20(25(34)29-22-8-6-5-7-9-22)16-24(23)33-27(31)30-32(28(33)36)17-21-15-18(2)10-11-19(21)3/h10-13,15-16,22H,4-9,14,17H2,1-3H3,(H,29,34)
C28H33N5O3487.5933121000
13146151

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-36-25-11-9-22(10-12-25)13-15-30-27(34)28(35)31-21-26(23-6-5-14-29-20-23)33-18-16-32(17-19-33)24-7-3-2-4-8-24/h2-12,14,20,26H,13,15-19,21H2,1H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933121000
13146160

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-21-5-7-22(8-6-21)18-30-27(34)28(35)31-20-26(23-4-3-13-29-19-23)33-16-14-32(15-17-33)24-9-11-25(36-2)12-10-24/h3-13,19,26H,14-18,20H2,1-2H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933121000
13146184

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-36-25-11-9-24(10-12-25)32-16-18-33(19-17-32)26(23-8-5-14-29-20-23)21-31-28(35)27(34)30-15-13-22-6-3-2-4-7-22/h2-12,14,20,26H,13,15-19,21H2,1H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933121000
13146190

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-21-9-11-22(12-10-21)18-30-27(34)28(35)31-20-25(23-6-5-13-29-19-23)33-16-14-32(15-17-33)24-7-3-4-8-26(24)36-2/h3-13,19,25H,14-18,20H2,1-2H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933121000
13146218

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C28H33N5O3/c1-36-26-12-6-5-11-24(26)32-16-18-33(19-17-32)25(23-10-7-14-29-20-23)21-31-28(35)27(34)30-15-13-22-8-3-2-4-9-22/h2-12,14,20,25H,13,15-19,21H2,1H3,(H,30,34)(H,31,35)
C28H33N5O3487.5933121000
21036196
InChI=1/C28H33N5O3/c1-3-4-5-6-7-11-18-33-26(34)24-25(30(2)28(33)35)29-27-31(19-20-32(24)27)21-14-16-23(17-15-21)36-22-12-9-8-10-13-22/h8-10,12-17H,3-7,11,18-20H2,1-2H3
C28H33N5O3487.593312600
12345

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