basic_info |
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Product_Name: | ACETIC ACID ACO-DI-ME-(TRIMETHYL-HEX-2-ENYL)-CYCLOPENTA(A)PHENANTHREN-3-YL ESTER |
EnglishSynonyms: | ACETIC ACID ACO-DI-ME-(TRIMETHYL-HEX-2-ENYL)-CYCLOPENTA(A)PHENANTHREN-3-YL ESTER |
pro_mdlNumber: | MFCD00267490 |
pro_acceptors: | 4 |
pro_donors: | 0 |
pro_smile: | CC(C)C(C)/C=C/C(C)C1CCC2C1(CC=C3C2=CC[C@@]4(C3(CCC(C4)OC(=O)C)C)OC(=O)C)C |
InChi: | InChI=1S/C32H48O4/c1-20(2)21(3)9-10-22(4)27-11-12-28-26-14-18-32(36-24(6)34)19-25(35-23(5)33)13-17-31(32,8)29(26)15-16-30(27,28)7/h9-10,14-15,20-22,25,27-28H,11-13,16-19H2,1-8H3/b10-9+/t21?,22?,25?,27?,28?,30?,31?,32-/m1/s1 |
InChiKey: | InChIKey=HWGLLOQQLAABPK-LEVIXYAVSA-N |
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