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Sesquiterpenes from the soil-derived fungus Trichoderma citrinoviride PSU-SPSF346

Wiriya Yaosanit, Vatcharin Rukachaisirikul, Souwalak Phongpaichit, Sita Preedanon and Jariya Sakayaroj

Beilstein J. Org. Chem. 2022, 18, 479–485. https://doi.org/10.3762/bjoc.18.50

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Chemical structure C<sub>15</sub>H<sub>22</sub>O<sub>5</sub>

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Figure 2

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₅H₂₂O₅
Molecular Weight	282.33 g/mol
Exact Mass	282.1467 Da
InChI	InChI=1S/C15H22O5/c1-9(2)13-4-3-10(8-16)5-11(13)6-12(15(19)20)7-14(17)18/h5-6,9,11,13,16H,3-4,7-8H2,1-2H3,(H,17,18)(H,19,20)/b12-6+
InChIKey	ZEHFJYNPGKOAAZ-WUXMJOGZSA-N
SMILES	CC(C)C1CCC(=CC1/C=C(\CC(=O)O)/C(=O)O)CO
Number of Atoms	42
Number of H-Bond Acceptors	5
Number of H-Bond Donors	3
Atoms in the Largest π-System	5
XLogP	1.8

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