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 782 results

Search term: C27H33N3O7 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10405461


5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H33N3O7/c1-14(2)11-20-29-18-12-15(35-5)8-9-16(18)21-22(29)19(13-26(3,4)37-36-20)30-24(32)17-7-6-10-28(17)25(33)27(30,34)23(21)31/h8-9,11-12,17,19-20,23,31,34H,6-7,10,13H2,1-5H3/t17-,19-,20+,23-,27+/m0/s1
C27H33N3O7511.5668303300
2920432
InChI=1/C27H33N3O7/c1-4-37-27(34)19-12-14-30(15-13-19)25(32)11-10-24(31)28-20-16-23(36-3)21(17-22(20)35-2)29-26(33)18-8-6-5-7-9-18/h5-9,16-17,19H,4,10-15H2,1-3H3,(H,28,31)(H,29,33)
C27H33N3O7511.5668213900
3168891

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-3-34-23-16-21(29-7-9-33-10-8-29)24(35-4-2)15-20(23)28-27(32)18-13-26(31)30(17-18)19-5-6-22-25(14-19)37-12-11-36-22/h5-6,14-16,18H,3-4,7-13,17H2,1-2H3,(H,28,32)
C27H33N3O7511.566812900
2112785
InChI=1/C25H31N3O3.C2H2O4/c1-6-20-17(2)25(19-9-7-8-10-21(19)26-20)27-24(29)16-28(3)14-13-18-11-12-22(30-4)23(15-18)31-5;3-1(4)2(5)6/h7-12,15H,6,13-14,16H2,1-5H3,(H,26,27,29);(H,3,4)(H,5,6)
C27H33N3O7511.56682121100
12274792

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-6-8-19(35-3)9-7-18)30(26(33)25(21)32)11-5-10-29-12-14-37-15-13-29/h6-9,23,28,32H,5,10-15H2,1-4H3
C27H33N3O7511.566811700
12274794

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-7-5-8-19(15-18)35-3)30(26(33)25(21)32)10-6-9-29-11-13-37-14-12-29/h5,7-8,15,23,28,32H,6,9-14H2,1-4H3
C27H33N3O7511.566811800
12274833

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-8-5-6-9-19(18)35-3)30(26(33)25(21)32)11-7-10-29-12-14-37-15-13-29/h5-6,8-9,23,28,32H,7,10-15H2,1-4H3
C27H33N3O7511.566811700
12274847

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-5-37-19-8-6-18(7-9-19)23-21(24(31)20-16(2)22(27(34)35-4)28-17(20)3)25(32)26(33)30(23)11-10-29-12-14-36-15-13-29/h6-9,23,28,32H,5,10-15H2,1-4H3
C27H33N3O7511.566811700
12280633

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-7-29(8-2)13-14-30-22(17-9-11-18(12-10-17)26(34)36-5)20(24(32)25(30)33)23(31)19-15(3)21(27(35)37-6)28-16(19)4/h9-12,22,28,32H,7-8,13-14H2,1-6H3
C27H33N3O7511.566811800
12280956

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-7-37-27(35)21-15(2)19(16(3)28-21)23(31)20-22(17-9-11-18(12-10-17)26(34)36-6)30(25(33)24(20)32)14-8-13-29(4)5/h9-12,22,28,32H,7-8,13-14H2,1-6H3
C27H33N3O7511.566811800
21961637

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-4-35-24-16-20(8-13-23(24)36-17-25(32)30-14-6-5-7-15-30)27(34)37-18(2)26(33)29-22-11-9-21(10-12-22)28-19(3)31/h8-13,16,18H,4-7,14-15,17H2,1-3H3,(H,28,31)(H,29,33)
C27H33N3O7511.566810800
10879653

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H31N3O3.C2H2O4/c1-19(20-9-11-22(12-10-20)21-6-3-2-4-7-21)26-24(29)18-27-13-15-28(16-14-27)25(30)23-8-5-17-31-23;3-1(4)2(5)6/h2-4,6-7,9-12,19,23H,5,8,13-18H2,1H3,(H,26,29);(H,3,4)(H,5,6)
C27H33N3O7511.566810800
11030389

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H31N3O3.C2H2O4/c1-30-23-13-8-19(14-24(23)31-2)25-20(15-26-21-9-11-22(29)12-10-21)17-28(27-25)16-18-6-4-3-5-7-18;3-1(4)2(5)6/h3-8,13-14,17,21-22,26,29H,9-12,15-16H2,1-2H3;(H,3,4)(H,5,6)
C27H33N3O7511.56689700
3370954

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33N3O7/c1-29-24(16-6-7-19(34-2)20(12-16)35-3)23(27(33)30-10-8-15(9-11-30)25(28)31)17-13-21(36-4)22(37-5)14-18(17)26(29)32/h6-7,12-15,23-24H,8-11H2,1-5H3,(H2,28,31)
C27H33N3O7511.566829700
4728683

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-5-37-19-8-6-18(7-9-19)23-21(24(31)20-16(2)22(27(34)35-4)28-17(20)3)25(32)26(33)30(23)11-10-29-12-14-36-15-13-29/h6-9,23,28,31H,5,10-15H2,1-4H3/b24-21+
C27H33N3O7511.56689900
4735566

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-7-5-8-19(15-18)35-3)30(26(33)25(21)32)10-6-9-29-11-13-37-14-12-29/h5,7-8,15,23,28,31H,6,9-14H2,1-4H3/b24-21+
C27H33N3O7511.566891000
4740750

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-8-5-6-9-19(18)35-3)30(26(33)25(21)32)11-7-10-29-12-14-37-15-13-29/h5-6,8-9,23,28,31H,7,10-15H2,1-4H3/b24-21+
C27H33N3O7511.56689900
4751902

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-7-29(8-2)13-14-30-22(17-9-11-18(12-10-17)26(34)36-5)20(24(32)25(30)33)23(31)19-15(3)21(27(35)37-6)28-16(19)4/h9-12,22,28,31H,7-8,13-14H2,1-6H3/b23-20+
C27H33N3O7511.56689900
4768529

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-7-37-27(35)21-15(2)19(16(3)28-21)23(31)20-22(17-9-11-18(12-10-17)26(34)36-6)30(25(33)24(20)32)14-8-13-29(4)5/h9-12,22,28,31H,7-8,13-14H2,1-6H3/b23-20+
C27H33N3O7511.56689900
4796114

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H33N3O7/c1-16-20(17(2)28-22(16)27(34)36-4)24(31)21-23(18-6-8-19(35-3)9-7-18)30(26(33)25(21)32)11-5-10-29-12-14-37-15-13-29/h6-9,23,28,31H,5,10-15H2,1-4H3/b24-21+
C27H33N3O7511.56689900
12345

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