Basic Information |
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Product Name: | 3,29-DIBENZOYL RAROUNITRIOL |
CAS: | 873001-54-8 |
English Synonyms: | 3,29-DIBENZOYL RAROUNITRIOL |
MDL Number.: | MFCD12032051 |
H bond acceptor: | 5 |
H bond donor: | 1 |
Smile: | CC1([C@@H](CC[C@]2([C@H]1C[C@@H](C3=C2CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)COC(=O)c6ccccc6)C)C)C)O)C)OC(=O)c7ccccc7)C |
InChi: | InChI=1S/C44H58O5/c1-39(2)33-26-32(45)36-31(42(33,5)20-19-35(39)49-38(47)30-16-12-9-13-17-30)18-21-43(6)34-27-40(3,22-23-41(34,4)24-25-44(36,43)7)28-48-37(46)29-14-10-8-11-15-29/h8-17,32-35,45H,18-28H2,1-7H3/t32-,33-,34+,35+,40+,41+,42+,43-,44+/m0/s1 |
InChiKey: | InChIKey=ZRKGVMOZKMBTHF-DUVCPVCPSA-N |
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