CID6443081

1-O-[(E)-5-[(11-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl)methoxy]-3-methyl-5-oxopent-3-enyl] 6-O-(2-trimethylsilylethyl) (2E,4E)-hexa-2,4-dienedioate

Also Known As: Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,5-dioxo-5-(2-(trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(E(2E,4Z)))-|Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,5-dioxo-5-(2-(trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(Z(2E,4Z)))-|Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,6-dioxo-6-(2-trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(2E,5(2E,4E)))-|Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,5-dioxo-5-(2-(trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(E(2E,4Z)))-

Molecular Formula	C32H46O9Si
Molecular Weight	602.29114 g/mol
LogP	4.4368
Topological Polar Surface Area	120.89 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	12
Exact Mass	602.29114
Monoisotopic Mass	602.29114
Heavy Atoms	42
Complexity	1174.8568

Chemical Identifiers

CAS Number	89016-44-4
SMILES	CC1=CC2C(CC1)(C3(C(CC(C34CO4)O2)O)C)COC(=O)/C=C(\C)/CCOC(=O)/C=C/C=C/C(=O)OCC[Si](C)(C)C