TETRONASIN

CAS No.
75139-06-9
CCD No.
CCD00176039
Formula
C35 H54 O8
MolWeight
602.804

Basic Information

Product Name: TETRONASIN
CAS: 75139-06-9
English Synonyms: TETRONASIN
MDL Number.: MFCD00867474
H bond acceptor: 8
H bond donor: 2
Smile: C[C@@H]1CCC[C@@H]([C@H]1[C@H](C)C(=O)C2=C(COC2=O)O)/C=C(\CO)/[C@H]3[C@@H](CC[C@H](O3)/C=C/[C@H](C)[C@H]4[C@H](C[C@@H](O4)[C@H](C)OC)C)C
InChi: InChI=1S/C35H54O8/c1-19-9-8-10-25(30(19)23(5)32(38)31-28(37)18-41-35(31)39)16-26(17-36)34-21(3)12-14-27(42-34)13-11-20(2)33-22(4)15-29(43-33)24(6)40-7/h11,13,16,19-25,27,29-30,33-34,36-37H,8-10,12,14-15,17-18H2,1-7H3/b13-11+,26-16+/t19-,20+,21-,22+,23+,24+,25-,27-,29-,30-,33+,34-/m1/s1
InChiKey: InChIKey=BJUFZCRLMQPLMO-RHKPWOOXSA-N

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