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 3 results

Search term: URGDJCBVOFJTIO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
341643

10 of 15 defined stereocentres - 10/15 defined
InChI=1/C37H56O10/c1-18-19(2)23(40)16-37-14-11-25-35(7)13-12-28(45-21(4)39)34(5,6)27(35)15-29(36(25,8)26(37)10-9-22(18)37)47-33-32(43)31(42)30(41)24(46-33)17-44-20(3)38/h10,18,22-25,27-33,40-43H,2,9,11-17H2,1,3-8H3/t18-,22-,23-,24?,25+,27-,28+,29+,30?,31?,32?,33?,35+,36+,37+/m0/s1
C37H56O10660.83455400
8207896

15 of 15 defined stereocentres - 15/15 defined
InChI=1/C37H56O10/c1-18-19(2)23(40)16-37-14-11-25-35(7)13-12-28(45-21(4)39)34(5,6)27(35)15-29(36(25,8)26(37)10-9-22(18)37)47-33-32(43)31(42)30(41)24(46-33)17-44-20(3)38/h10,18,22-25,27-33,40-43H,2,9,11-17H2,1,3-8H3/t18-,22-,23-,24+,25+,27-,28+,29+,30+,31-,32+,33-,35+,36+,37+/m0/s1
C37H56O10660.83454300
2967715

0 of 15 defined stereocentres - 0/15 defined
InChI=1/C37H56O10/c1-18-19(2)23(40)16-37-14-11-25-35(7)13-12-28(45-21(4)39)34(5,6)27(35)15-29(36(25,8)26(37)10-9-22(18)37)47-33-32(43)31(42)30(41)24(46-33)17-44-20(3)38/h10,18,22-25,27-33,40-43H,2,9,11-17H2,1,3-8H3
C37H56O10660.8345399999983200

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