(Q104391478)

English

[(1R,2R,4S,7R,8S,12R,19S)-7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-19-yl] acetate

group of stereoisomers with the chemical formula C₂₈H₃₄O₇

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Statements

group of stereoisomers

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chemical compound

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482.23045342799986 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₃₄O₇

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canonical SMILES

O=C(OC1CC2C(C=CC(=O)C2(C)C)(C)C3CCC4(C)C(OC(=O)C5OC54C13C)C6=COC=C6)C

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isomeric SMILES

CC(=O)O[C@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C2CC[C@@]3(C)[C@@H](c4ccoc4)OC(=O)[C@H]4O[C@]43[C@]21C

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Identifiers

InChI=1S/C28H34O7/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)34-23(31)22-28(26,35-22)27(17,20)6/h8-10,12,14,17-18,20-22H,7,11,13H2,1-6H3/t17?,18?,20-,21+,22+,25+,26-,27+,28+/m0/s1

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YJXDGWUNRYLINJ-UKZLNSFASA-N

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1 reference

26 December 2021

UniChem compound ID

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