COSALANE

CAS No.
154212-56-3
CCD No.
CCD00180064
Formula
C45 H60 Cl2 O6
MolWeight
767.869

Basic Information

Product Name: COSALANE
CAS: 154212-56-3
English Synonyms: COSALANE
MDL Number.: MFCD00920790
H bond acceptor: 6
H bond donor: 4
Smile: CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CC[C@@H](C4)CCC=C(c5cc(c(c(c5)Cl)O)C(=O)O)c6cc(c(c(c6)Cl)O)C(=O)O)C)C
InChi: InChI=1S/C45H60Cl2O6/c1-25(2)8-6-9-26(3)35-14-15-36-32-13-12-30-20-27(16-18-44(30,4)37(32)17-19-45(35,36)5)10-7-11-31(28-21-33(42(50)51)40(48)38(46)23-28)29-22-34(43(52)53)41(49)39(47)24-29/h11,21-27,30,32,35-37,48-49H,6-10,12-20H2,1-5H3,(H,50,51)(H,52,53)/t26-,27+,30?,32+,35-,36+,37+,44+,45-/m1/s1
InChiKey: InChIKey=VOJOOGPALCATLT-DBUIBTPCSA-N

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