Basic Information |
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Product Name: | (ACO-HO-DI-ME-HEXADECAHYDRO-CYCLOPENTA(A)PHENANTHREN-YL)-PENTANOIC ACID ME ESTER |
English Synonyms: | (ACO-HO-DI-ME-HEXADECAHYDRO-CYCLOPENTA(A)PHENANTHREN-YL)-PENTANOIC ACID ME ESTER |
MDL Number.: | MFCD00226825 |
H bond acceptor: | 5 |
H bond donor: | 1 |
Smile: | CC(CCC(=O)OC)C1CCC2[C@@]1(C(CC3C2CC[C@H]4[C@@]3(CC[C@H](C4)OC(=O)C)C)O)C |
InChi: | InChI=1S/C27H44O5/c1-16(6-11-25(30)31-5)21-9-10-22-20-8-7-18-14-19(32-17(2)28)12-13-26(18,3)23(20)15-24(29)27(21,22)4/h16,18-24,29H,6-15H2,1-5H3/t16?,18-,19-,20?,21?,22?,23?,24?,26+,27-/m1/s1 |
InChiKey: | InChIKey=FVYCOKNQUSFTBH-IOBAMQISSA-N |
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