Basic Information |
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Product Name: | BAFILOMYCIN B2 |
CAS: | 88907-48-6 |
English Synonyms: | BAFILOMYCIN B2 |
MDL Number.: | MFCD07783959 |
H bond acceptor: | 14 |
H bond donor: | 4 |
Smile: | C[C@H]1C/C(=C/C=C/[C@@H]([C@H](OC(=O)/C(=C\C(=C\[C@H]([C@H]1O)C)\C)/OC)[C@@H](C)[C@H]([C@H](C)[C@]2(C[C@H]([C@H]([C@H](O2)C(C)C)C)OC(=O)/C=C/C(=O)NC3=C(CCC3=O)O)OC)O)OC)/C |
InChi: | InChI=1S/C45H67NO13/c1-24(2)42-29(7)36(57-38(50)19-18-37(49)46-39-32(47)16-17-33(39)48)23-45(56-12,59-42)31(9)41(52)30(8)43-34(54-10)15-13-14-25(3)20-27(5)40(51)28(6)21-26(4)22-35(55-11)44(53)58-43/h13-15,18-19,21-22,24,27-31,34,36,40-43,47,51-52H,16-17,20,23H2,1-12H3,(H,46,49)/b15-13+,19-18+,25-14+,26-21+,35-22+/t27-,28+,29+,30-,31-,34-,36+,40-,41+,42+,43+,45+/m0/s1 |
InChiKey: | InChIKey=PZUWLJPPTRCBLM-GXGGIWSJSA-N |
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