| Name: | BRYOSTATIN 1 |
| CAS: | 83314-01-6 |
| Synonyms: | BRYO 1 ; BRYOSTATIN 1 ; B705008K112 |
| MDL.: | MFCD00893832 |
| H bond acceptor: | 17 |
| H bond donor: | 4 |
| Smile: | CCC/C=C/C=C/C(=O)O[C@H]1/C(=C/C(=O)OC)/C[C@H]2C[C@@H](OC(=O)C[C@@H](C[C@@H]3C[C@@H](C([C@@](O3)(C[C@@H]4C/C(=C/C(=O)OC)/C[C@@H](O4)/C=C/C([C@@]1(O2)O)(C)C)O)(C)C)OC(=O)C)O)[C@@H](C)O |
| InChi: | InChI=1S/C47H68O17/c1-10-11-12-13-14-15-39(51)62-43-31(22-41(53)58-9)21-34-25-37(28(2)48)61-42(54)24-32(50)23-35-26-38(59-29(3)49)45(6,7)46(55,63-35)27-36-19-30(20-40(52)57-8)18-33(60-36)16-17-44(4,5)47(43,56)64-34/h12-17,20,22,28,32-38,43,48,50,55-56H,10-11,18-19,21,23-27H2,1-9H3/b13-12+,15-14+,17-16+,30-20+,31-22+/t28-,32-,33+,34+,35-,36+,37-,38+,43+,46+,47-/m1/s1 |
| InChiKey: | InChIKey=MJQUEDHRCUIRLF-TVIXENOKSA-N |
Property |
|
| Melting Point: | 230-235 DEG C |
| Comments: | MERCK: 14,1457 ORIGINAL SKU: J63848-!E ORIGINAL SKU: J63848-!F RTECS: EH9455000 TSCA: N UNSPSC: 12000000 |
Safety information |
|
| hazard symbol: | Xn |
| Risk Code: | R:68 |
| Safe Code: | S:36/37 |
| WGK Germany: | 3 |
BRYOSTATIN 1
- Description
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