4-(3,7-DI-ACO-12-HO-10,13-DI-ME-CYCLOPENTA(A)PHENANTHREN-17-YL)-PENTANOIC ACID

pro_cas
pro_cdbregno
CCD08035804
pro_formula
C28 H44 O7
pro_molWeight
492.649

basic_info

Product_Name: 4-(3,7-DI-ACO-12-HO-10,13-DI-ME-CYCLOPENTA(A)PHENANTHREN-17-YL)-PENTANOIC ACID
EnglishSynonyms: 4-(3,7-DI-ACO-12-HO-10,13-DI-ME-CYCLOPENTA(A)PHENANTHREN-17-YL)-PENTANOIC ACID
pro_mdlNumber: MFCD00267632
pro_acceptors: 7
pro_donors: 2
pro_smile: CC(CCC(=O)O)C1CCC2C1(C(CC3C2[C@@H](CC4C3(CC[C@H](C4)OC(=O)C)C)OC(=O)C)O)C
InChi: InChI=1S/C28H44O7/c1-15(6-9-25(32)33)20-7-8-21-26-22(14-24(31)28(20,21)5)27(4)11-10-19(34-16(2)29)12-18(27)13-23(26)35-17(3)30/h15,18-24,26,31H,6-14H2,1-5H3,(H,32,33)/t15?,18?,19-,20?,21?,22?,23-,24?,26?,27?,28?/m1/s1
InChiKey: InChIKey=BKPNMUHLOXZELU-AWICKIAMSA-N

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