basic_info |
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Product_Name: | OLEAN-9(11)-EN-28-OIC ACID, 3-(ACETYLOXY)-12-OXO-, METHYL ESTER, (3B)- |
CAS: | 65023-20-3 |
EnglishSynonyms: | (4AS,6AR,6BS,10S,12AS,14AR,14BR)-METHYL 10-ACETOXY-2,2,6A,6B,9,9,12A-HEPTAMETHYL-14-OXO-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12, ; OLEAN-9(11)-EN-28-OIC ACID, 3-(ACETYLOXY)-12-OXO-, METHYL ESTER, (3B)- |
pro_mdlNumber: | MFCD13194180 |
pro_acceptors: | 5 |
pro_donors: | 0 |
pro_smile: | CC(=O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]3(C2=CC(=O)[C@H]4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)OC)C)C)C |
InChi: | InChI=1S/C33H50O5/c1-20(34)38-25-11-12-30(6)23(29(25,4)5)10-13-31(7)24(30)18-22(35)26-21-19-28(2,3)14-16-33(21,27(36)37-9)17-15-32(26,31)8/h18,21,23,25-26H,10-17,19H2,1-9H3/t21-,23-,25-,26-,30-,31+,32+,33-/m0/s1 |
InChiKey: | InChIKey=MHESADREAJTXQD-MKPWSPEMSA-N |
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