basic_info |
|
| Product_Name: | 3BETA,14,16BETA-TRIHYDROXY-5BETA-CARD-20(22)-ENOLIDE 16-FORMATE |
| CAS: | 514-21-6 |
| EnglishSynonyms: | 3BETA,14,16BETA-TRIHYDROXY-5BETA-CARD-20(22)-ENOLIDE 16-FORMATE |
| pro_mdlNumber: | MFCD01740263 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(C[C@@H]([C@@H]4C5=CC(=O)OC5)OC=O)O)C)O |
| InChi: | InChI=1S/C24H34O6/c1-22-7-5-16(26)10-15(22)3-4-18-17(22)6-8-23(2)21(14-9-20(27)29-12-14)19(30-13-25)11-24(18,23)28/h9,13,15-19,21,26,28H,3-8,10-12H2,1-2H3/t15-,16+,17+,18-,19+,21+,22+,23-,24+/m1/s1 |
| InChiKey: | InChIKey=WPPUBSWJDJKYDK-QDLCSJEJSA-N |
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