basic_info |
|
| Product_Name: | LYNGBYATOXIN A |
| CAS: | 70497-14-2 |
| EnglishSynonyms: | LYNGBYATOXIN A |
| pro_mdlNumber: | MFCD01310444 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | CC(C)[C@H]1C(=O)N[C@@H](Cc2c[nH]c3c2c(ccc3[C@](C)(CCC=C(C)C)C=C)N1C)CO |
| InChi: | InChI=1S/C27H39N3O2/c1-8-27(6,13-9-10-17(2)3)21-11-12-22-23-19(15-28-24(21)23)14-20(16-31)29-26(32)25(18(4)5)30(22)7/h8,10-12,15,18,20,25,28,31H,1,9,13-14,16H2,2-7H3,(H,29,32)/t20-,25-,27-/m0/s1 |
| InChiKey: | InChIKey=KISDGNGREAJPQR-OICBGKIFSA-N |
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