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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 84 results

Search term: C29H41NO7 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
16736409

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C29H41NO7/c1-35-15-16-36-19-23(27(33)37-25-12-9-20-5-4-6-22(20)17-25)18-29(13-2-3-14-29)28(34)30-24-10-7-21(8-11-24)26(31)32/h9,12,17,21,23-24H,2-8,10-11,13-16,18-19H2,1H3,(H,30,34)(H,31,32)/t21-,23-,24+/m0/s1
C29H41NO7515.63833541581
108916

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C29H41NO7/c1-35-15-16-36-19-23(27(33)37-25-12-9-20-5-4-6-22(20)17-25)18-29(13-2-3-14-29)28(34)30-24-10-7-21(8-11-24)26(31)32/h9,12,17,21,23-24H,2-8,10-11,13-16,18-19H2,1H3,(H,30,34)(H,31,32)
C29H41NO7515.6383155300
17462829

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-19(2)13-18-32-21-11-9-20(10-12-21)30-26(31)24-22-23(35-28(34-22)14-5-3-6-15-28)25-27(33-24)37-29(36-25)16-7-4-8-17-29/h9-12,19,22-25,27H,3-8,13-18H2,1-2H3,(H,30,31)/t22-,23+,24+,25-,27-/m1/s1
C29H41NO7515.638313900
3798704

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C29H41NO7/c1-20(2)30(21-12-6-3-7-13-21)23(31)19-32-25-24(22-18-33-28(35-22)14-8-4-9-15-28)34-27-26(25)36-29(37-27)16-10-5-11-17-29/h3,6-7,12-13,20,22,24-27H,4-5,8-11,14-19H2,1-2H3
C29H41NO7515.6383411400
4515031

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C29H41NO7/c1-35-15-16-36-19-23(27(33)37-25-12-9-20-5-4-6-22(20)17-25)18-29(13-2-3-14-29)28(34)30-24-10-7-21(8-11-24)26(31)32/h9,12,17,21,23-24H,2-8,10-11,13-16,18-19H2,1H3,(H,30,34)(H,31,32)/t21?,23-,24?/m0/s1
C29H41NO7515.6383101200
5050455

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C29H41NO7/c1-20(2)30(21-12-6-3-7-13-21)23(31)19-32-25-24(22-18-33-28(35-22)14-8-4-9-15-28)34-27-26(25)36-29(37-27)16-10-5-11-17-29/h3,6-7,12-13,20,22,24-27H,4-5,8-11,14-19H2,1-2H3/t22?,24-,25+,26-,27-/m1/s1
C29H41NO7515.638310600
17462918

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-2-3-10-19-32-21-13-11-20(12-14-21)30-26(31)24-22-23(35-28(34-22)15-6-4-7-16-28)25-27(33-24)37-29(36-25)17-8-5-9-18-29/h11-14,22-25,27H,2-10,15-19H2,1H3,(H,30,31)/t22-,23+,24+,25-,27-/m0/s1
C29H41NO7515.638310700
21812516

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-2-3-10-19-32-21-13-11-20(12-14-21)30-26(31)24-22-23(35-28(34-22)15-6-4-7-16-28)25-27(33-24)37-29(36-25)17-8-5-9-18-29/h11-14,22-25,27H,2-10,15-19H2,1H3,(H,30,31)/t22-,23+,24+,25-,27-/m1/s1
C29H41NO7515.63839700
4367291

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C29H41NO7/c1-2-3-10-19-32-21-13-11-20(12-14-21)30-26(31)24-22-23(35-28(34-22)15-6-4-7-16-28)25-27(33-24)37-29(36-25)17-8-5-9-18-29/h11-14,22-25,27H,2-10,15-19H2,1H3,(H,30,31)
C29H41NO7515.638349500
21347228

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H39NO3.C2H2O4/c1-20(2)31-24-13-11-23(12-14-24)25(22-8-6-5-7-9-22)16-17-28-19-21-10-15-26(29-3)27(18-21)30-4;3-1(4)2(5)6/h10-15,18,20,22,25,28H,5-9,16-17,19H2,1-4H3;(H,3,4)(H,5,6)
C29H41NO7515.63837700
28525886

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C29H41NO7/c1-35-15-16-36-19-23(27(33)37-25-12-9-20-5-4-6-22(20)17-25)18-29(13-2-3-14-29)28(34)30-24-10-7-21(8-11-24)26(31)32/h9,12,17,21,23-24H,2-8,10-11,13-16,18-19H2,1H3,(H,30,34)(H,31,32)/t21-,23?,24+
C29H41NO7515.63835500
8729282

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C29H41NO7/c1-7-26(4)17-20(32)29(35)27(5)19(31)13-15-25(2,3)22(27)21(33)23(28(29,6)37-26)36-24(34)30-16-14-18-11-9-8-10-12-18/h7-12,19,21-23,31,33,35H,1,13-17H2,2-6H3,(H,30,34)/t19-,21-,22-,23-,26-,27-,28+,29-/m0/s1
C29H41NO7515.63835400
8943483

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C29H41NO7/c1-7-26(4)17-20(32)29(35)27(5)19(31)13-15-25(2,3)22(27)21(23(33)28(29,6)37-26)36-24(34)30-16-14-18-11-9-8-10-12-18/h7-12,19,21-23,31,33,35H,1,13-17H2,2-6H3,(H,30,34)/t19-,21-,22-,23-,26-,27-,28+,29-/m0/s1
C29H41NO7515.63835400
60574761

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-18(2)9-8-13-29(6)21-15-19-16-30(27(33)37-28(3,4)5)14-12-22(19)35-25(21)20-10-7-11-23(26(20)36-29)34-17-24(31)32/h7,9-11,19,21-22,25H,8,12-17H2,1-6H3,(H,31,32)/t19-,21-,22-,25+,29-/m0/s1
C29H41NO7515.63834300
60574764

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-18(2)8-7-12-29(6)22-14-19-16-30(27(33)37-28(3,4)5)13-11-23(19)35-26(22)21-10-9-20(15-24(21)36-29)34-17-25(31)32/h8-10,15,19,22-23,26H,7,11-14,16-17H2,1-6H3,(H,31,32)/t19-,22-,23-,26+,29-/m0/s1
C29H41NO7515.63834300
60574772

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-18(2)8-7-12-29(6)22-14-19-16-30(27(33)37-28(3,4)5)13-11-23(19)35-26(22)21-15-20(34-17-25(31)32)9-10-24(21)36-29/h8-10,15,19,22-23,26H,7,11-14,16-17H2,1-6H3,(H,31,32)/t19-,22-,23-,26+,29+/m0/s1
C29H41NO7515.63834300
60574804

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C29H41NO7/c1-18(2)8-7-12-29(6)22-14-19-16-30(27(33)37-28(3,4)5)13-11-23(19)35-26(22)21-10-9-20(15-24(21)36-29)34-17-25(31)32/h8-10,15,19,22-23,26H,7,11-14,16-17H2,1-6H3,(H,31,32)/t19-,22-,23-,26+,29+/m0/s1
C29H41NO7515.63834300
17462185

2 of 8 defined stereocentres - 2/8 defined
InChI=1/C29H41NO7/c1-28-12-10-18(31)14-17(28)4-5-20-21-6-7-24(29(21,2)13-11-22(20)28)37-26(34)9-8-25(33)30-16-19(32)15-23(30)27(35)36-3/h14,19-24,32H,4-13,15-16H2,1-3H3/t19?,20?,21?,22?,23?,24?,28-,29-/m0/s1
C29H41NO7515.63834100
9629953

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H41NO7/c1-4-11-24-26(14-13-23(21(3)31)29(24)30-5-2)33-15-8-6-9-16-34-27-20-36-22(18-25(27)32)19-37-28-12-7-10-17-35-28/h13-14,18,20,28,30H,4-12,15-17,19H2,1-3H3
C29H41NO7515.63833100
17269294

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C29H41NO7/c1-6-27(4)16-22(37-23(32)17-31)28(5)19(2)12-13-29(25(28)34,20(3)24(27)33)14-15-30-26(35)36-18-21-10-8-7-9-11-21/h6-11,19-20,22,24,31,33H,1,12-18H2,2-5H3,(H,30,35)/t19?,20-,22+,24-,27+,28-,29-/m0/s1
C29H41NO7515.63833300
12345

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