basic_info |
|
| Product_Name: | OLEAN-12-ENO[2,3-C][1,2,5]OXADIAZOL-28-OIC ACID METHYL ESTER |
| CAS: | 42273-08-5 |
| EnglishSynonyms: | OLEAN-12-ENO[2,3-C][1,2,5]OXADIAZOL-28-OIC ACID METHYL ESTER |
| pro_mdlNumber: | MFCD09752471 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | CC1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(Cc6c(non6)C5(C)C)C)C)[C@@H]2C1)C)C(=O)OC)C |
| InChi: | InChI=1S/C31H46N2O3/c1-26(2)13-15-31(25(34)35-8)16-14-29(6)19(20(31)17-26)9-10-23-28(5)18-21-24(33-36-32-21)27(3,4)22(28)11-12-30(23,29)7/h9,20,22-23H,10-18H2,1-8H3/t20-,22-,23+,28-,29+,30+,31-/m0/s1 |
| InChiKey: | InChIKey=UGHCEWKYYWFBPB-CFZUYSGLSA-N |
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