TENACISSOSIDE I

CAS No.
191729-44-9
CCD No.
CCD07396283
Formula
C44 H62 O14
MolWeight
814.96

Basic Information

Product Name: TENACISSOSIDE I
CAS: 191729-44-9
English Synonyms: TENACISSOSIDE I
MDL Number.: MFCD22417327
H bond acceptor: 14
H bond donor: 2
Smile: C[C@@H]1[C@H]([C@H]([C@H](C(O1)O[C@@H]2[C@H](O[C@H](C[C@H]2OC)O[C@H]3CC[C@]4([C@H](C3)CC[C@]56[C@@H]4[C@@H]([C@H]([C@]7([C@]5(O6)CC[C@@H]7C(=O)C)C)OC(=O)C)OC(=O)c8ccccc8)C)C)O)OC)O
InChi: InChI=1S/C44H62O14/c1-22(45)29-16-19-44-42(29,6)38(54-25(4)46)36(56-39(49)26-12-10-9-11-13-26)37-41(5)17-15-28(20-27(41)14-18-43(37,44)58-44)55-31-21-30(50-7)34(24(3)52-31)57-40-33(48)35(51-8)32(47)23(2)53-40/h9-13,23-24,27-38,40,47-48H,14-21H2,1-8H3/t23-,24-,27+,28+,29-,30-,31+,32-,33-,34-,35-,36+,37-,38-,40?,41+,42+,43+,44-/m1/s1
InChiKey: InChIKey=HXIHLBDNTFYMIC-FGXXFONCSA-N

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