basic_info |
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| Product_Name: | 1-(2-HYDROXY-JULOLIDIN-4-YL)-3-(1,4-DIHYDRO-2-HYDROXY-JULOLIDIN-4-YLIDENE-ONIUM)-2-OXO-CYCLOBUTEN-4-OLATE |
| CAS: | 93470-31-6 |
| EnglishSynonyms: | 1-(2-HYDROXY-JULOLIDIN-4-YL)-3-(1,4-DIHYDRO-2-HYDROXY-JULOLIDIN-4-YLIDENE-ONIUM)-2-OXO-CYCLOBUTEN-4-OLATE |
| pro_mdlNumber: | MFCD09842173 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | c\1c2c3=[N+](CCC2)CCCc3c(/c1=C/4\C(=C(C4=O)c5cc6c7c(c5O)CCCN7CCC6)[O-])O |
| InChi: | InChI=1S/C28H28N2O4/c31-25-17-7-3-11-29-9-1-5-15(23(17)29)13-19(25)21-27(33)22(28(21)34)20-14-16-6-2-10-30-12-4-8-18(24(16)30)26(20)32/h13-14H,1-12H2,(H2,31,32,33,34) |
| InChiKey: | InChIKey=BIRZMQMHPSJLDD-UHFFFAOYSA-N |
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