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 6 results

Search term: LCYUXNWXIFFGKV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21834749

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/t15?,16-,17-
C24H31NO6429.506141000
3052536

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)
C24H31NO6429.506043200
1396593

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/t15-,16?,17?/m0/s1
C24H31NO6429.5062100
1396597

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/t15-,16?,17?/m1/s1
C24H31NO6429.5062100
1396592

Charge

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/p-1/t15-,16?,17?/m0/s1
C24H30NO6428.49861100
1396596

Charge

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C24H31NO6/c1-4-5-18-12-21(26)31-22-14(2)20(11-10-19(18)22)30-15(3)23(27)25-13-16-6-8-17(9-7-16)24(28)29/h10-12,15-17H,4-9,13H2,1-3H3,(H,25,27)(H,28,29)/p-1/t15-,16?,17?/m1/s1
C24H30NO6428.49861100

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