basic_info |
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| Product_Name: | CHRYSANTHELLIN A |
| CAS: | 73039-13-1 |
| EnglishSynonyms: | PENTASACCHARIDE OF ECHINOCYSTIC ACID ; CHRYSANTHELLIN A |
| pro_mdlNumber: | MFCD00075717 |
| pro_acceptors: | 25 |
| pro_donors: | 14 |
| pro_smile: | C[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)O[C@H]2[C@@H](CO[C@H]([C@@H]2O)O[C@H]3[C@@H](O[C@@H]([C@@H]([C@@H]3O)O)O[C@@H]4[C@H]([C@@H](CO[C@@H]4OC(=O)[C@]56CCC(C[C@@H]5C7=CC[C@@H]8[C@]9(CC[C@@H](C([C@@H]9CC[C@]8([C@@]7(C[C@H]6O)C)C)(C)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)(C)C)O)O)C)O)O)O)O |
| InChi: | InChI=1S/C58H94O25/c1-23-34(63)37(66)40(69)48(76-23)81-45-28(61)22-74-47(43(45)72)80-44-24(2)77-49(42(71)39(44)68)82-46-35(64)27(60)21-75-51(46)83-52(73)58-17-16-53(3,4)18-26(58)25-10-11-31-55(7)14-13-33(79-50-41(70)38(67)36(65)29(20-59)78-50)54(5,6)30(55)12-15-56(31,8)57(25,9)19-32(58)62/h10,23-24,26-51,59-72H,11-22H2,1-9H3/t23-,24-,26+,27+,28+,29+,30-,31+,32+,33-,34-,35-,36+,37+,38-,39-,40+,41+,42+,43+,44-,45-,46+,47-,48+,49+,50-,51+,55-,56+,57+,58+/m0/s1 |
| InChiKey: | InChIKey=IBEZGTWSSFFKNB-JZEXCKIOSA-N |
property |
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| MeltingPoint: | 209-225 DEG C |
| Comments: | ASSAY BY HPLC PRODUCT CATEGORY: CHROMATOGRAPHY STANDARDS STORAGE CONDITIONS: ROOM TEMP STORAGE CONDITIONS: STORE IN A COOL DRY PLACE WITH HPLC |
secure_info |
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