GYMNEMIC ACID I

pro_cas
122168-40-5
pro_cdbregno
CCD01404675
pro_formula
C43 H66 O14
pro_molWeight
806.98

basic_info

Product_Name: GYMNEMIC ACID I
CAS: 122168-40-5
EnglishSynonyms: GYMNEMIC ACID I
pro_mdlNumber: MFCD12031624
pro_acceptors: 14
pro_donors: 7
pro_smile: C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@]2([C@@H](CC1(C)C)C3=CC[C@@H]4[C@]5(CC[C@@H]([C@@]([C@@H]5CC[C@]4([C@@]3(C[C@@H]2O)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)COC(=O)C)O
InChi: InChI=1S/C43H66O14/c1-10-21(2)36(53)57-34-33(50)43(20-54-22(3)45)24(17-38(34,4)5)23-11-12-26-39(6)15-14-28(55-37-31(49)29(47)30(48)32(56-37)35(51)52)40(7,19-44)25(39)13-16-41(26,8)42(23,9)18-27(43)46/h10-11,24-34,37,44,46-50H,12-20H2,1-9H3,(H,51,52)/b21-10+/t24-,25+,26+,27-,28-,29-,30-,31+,32-,33-,34-,37+,39-,40-,41+,42+,43-/m0/s1
InChiKey: InChIKey=VEFSVJGWJQPWFS-ZXKKMYOJSA-N

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