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 4 results

Search term: VWNXXDRIBVHHMQ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17467792

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H40N4O5/c1-5-30(37)13-10-24-22-7-6-19-14-20(8-11-28(19,2)23(22)9-12-29(24,30)3)34-39-17-26(35)33-25(27(36)38-4)15-21-16-31-18-32-21/h1,14,16,18,22-25,37H,6-13,15,17H2,2-4H3,(H,31,32)(H,33,35)/b34-20+/t22-,23+,24+,25?,28+,29+,30-/m1/s1
C30H40N4O5536.66248400
2822633

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C30H40N4O5/c1-5-30(37)13-10-24-22-7-6-19-14-20(8-11-28(19,2)23(22)9-12-29(24,30)3)34-39-17-26(35)33-25(27(36)38-4)15-21-16-31-18-32-21/h1,14,16,18,22-25,37H,6-13,15,17H2,2-4H3,(H,31,32)(H,33,35)
C30H40N4O5536.6623999999992100
62232509

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H40N4O5/c1-5-30(37)13-10-24-22-7-6-19-14-20(8-11-28(19,2)23(22)9-12-29(24,30)3)34-39-17-26(35)33-25(27(36)38-4)15-21-16-31-18-32-21/h1,14,16,18,22-25,37H,6-13,15,17H2,2-4H3,(H,31,32)(H,33,35)/t22-,23+,24+,25?,28+,29+,30-/m1/s1
C30H40N4O5536.66241100
113598097

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H40N4O5/c1-5-30(37)13-10-24-22-7-6-19-14-20(8-11-28(19,2)23(22)9-12-29(24,30)3)34-39-17-26(35)33-25(27(36)38-4)15-21-16-31-18-32-21/h1,14,16,18,22-25,37H,6-13,15,17H2,2-4H3,(H,31,32)(H,33,35)/b34-20+/t22-,23+,24+,25?,28+,29+,30-/m0/s1
C30H40N4O5536.66241100

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