2,4,5-TRI-O-BUTYRYL-MYO-INOSITOL-1,3,6-TRISPHOSPHATE-HEXAKIS(PROPIONOXYMETHYL) ESTER

CAS No.
CCD No.
CCD00441490
Formula
C42 H69 O29 P3
MolWeight
1130.9

Basic Information

Product Name: 2,4,5-TRI-O-BUTYRYL-MYO-INOSITOL-1,3,6-TRISPHOSPHATE-HEXAKIS(PROPIONOXYMETHYL) ESTER
English Synonyms: BT3-INS (1,3,6)P3/PM ; 2,4,5-TRI-O-BUTYRYL-MYO-INOSITOL-1,3,6-TRISPHOSPHATE-HEXAKIS(PROPIONOXYMETHYL) ESTER
MDL Number.: MFCD04036995
H bond acceptor: 29
H bond donor: 0
Smile: CCCC(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H]([C@@H]1OP(=O)(OCOC(=O)CC)OCOC(=O)CC)OC(=O)CCC)OP(=O)(OCOC(=O)CC)OCOC(=O)CC)OP(=O)(OCC(=O)CC)OCOC(=O)CC)OC(=O)CCC
InChi: InChI=1S/C42H69O29P3/c1-10-19-34(49)66-37-38(67-35(50)20-11-2)41(70-72(52,60-22-28(43)13-4)61-23-55-29(44)14-5)42(71-74(54,64-26-58-32(47)17-8)65-27-59-33(48)18-9)39(68-36(51)21-12-3)40(37)69-73(53,62-24-56-30(45)15-6)63-25-57-31(46)16-7/h37-42H,10-27H2,1-9H3/t37-,38-,39+,40+,41+,42+,72?/m0/s1
InChiKey: InChIKey=RKXDOXDZSYJFJQ-SLWVKJIKSA-N

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