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ECHINOCANDIN B B Echinocandin B 1-((4r,5r)-4,5-dihydroxy-l-ornithine)echinocandin b
Basic Information |
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Product Name: | 1-[(4R,5R)-4,5-DIHYDROXY-L-ORNITHINE]-ECHINOCANDIN B |
CAS: | 79411-15-7 |
English Synonyms: | ECHINOCANDIN B, 1-[(4R,5R)-4,5-DIHYDROXY-L-ORNITHINE]- ; 1-[(4R,5R)-4,5-DIHYDROXY-L-ORNITHINE]-ECHINOCANDIN B |
MDL Number.: | MFCD17676165 |
H bond acceptor: | 22 |
H bond donor: | 14 |
Smile: | C[C@H]1CN2[C@@H]([C@H]1O)C(=O)N[C@@H]([C@@H](C[C@@H](C(=O)N[C@H](C(=O)N3C[C@@H](C[C@H]3C(=O)N[C@H](C(=O)N[C@H](C2=O)[C@@H](C)O)[C@@H]([C@H](c4ccc(cc4)O)O)O)O)[C@@H](C)O)N)O)O |
InChi: | InChI=1S/C34H51N7O15/c1-12-10-41-24(25(12)47)32(54)39-30(52)20(46)9-18(35)28(50)36-21(13(2)42)33(55)40-11-17(45)8-19(40)29(51)38-23(31(53)37-22(14(3)43)34(41)56)27(49)26(48)15-4-6-16(44)7-5-15/h4-7,12-14,17-27,30,42-49,52H,8-11,35H2,1-3H3,(H,36,50)(H,37,53)(H,38,51)(H,39,54)/t12-,13+,14+,17+,18-,19-,20+,21-,22-,23-,24-,25-,26-,27-,30+/m0/s1 |
InChiKey: | InChIKey=BLKJKIJFNJAQIZ-UMDMRRTDSA-N |
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