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
Additional Filters

Found 3 results

Search term: TUCCRVXYEZZAAX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10145992

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H34O12/c1-11(2)7-17(31)40-20-22-27-10-37-28(22,25(35)36-6)23(33)18(32)21(27)26(5)9-15(30)19(38-13(4)29)12(3)14(26)8-16(27)39-24(20)34/h7,14,16,18,20-23,32-33H,8-10H2,1-6H3/t14-,16+,18+,20+,21+,22+,23-,26-,27+,28-/m0/s1
C28H34O12562.56245300
29420585

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C28H34O12/c1-11(2)7-17(31)40-20-22-27-10-37-28(22,25(35)36-6)23(33)18(32)21(27)26(5)9-15(30)19(38-13(4)29)12(3)14(26)8-16(27)39-24(20)34/h7,14,16,18,20-23,32-33H,8-10H2,1-6H3/t14-,16-,18+,20+,21-,22-,23+,26+,27-,28+/m1/s1
C28H34O12562.56242200
356272

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C28H34O12/c1-11(2)7-17(31)40-20-22-27-10-37-28(22,25(35)36-6)23(33)18(32)21(27)26(5)9-15(30)19(38-13(4)29)12(3)14(26)8-16(27)39-24(20)34/h7,14,16,18,20-23,32-33H,8-10H2,1-6H3/t14-,16+,18+,20+,21+,22+,23-,26-,27+,28?/m0/s1
C28H34O12562.56242100

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