(Q105111231)

English

[1-Acetyloxy-10-ethoxy-3,5-dihydroxy-7,8-dimethyl-7-(3-methylpenta-2,4-dienyl)-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-9-yl] butanoate

group of stereoisomers with the chemical formula C₂₈H₄₂O₈

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

506.2879683039998 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₄₂O₈

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canonical SMILES

O=C(OC1OC(O)C2=CC(O)CC3C21C(OCC)C(OC(=O)CCC)C(C)C3(C)CC=C(C=C)C)C

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Identifiers

InChI=1S/C28H42O8/c1-8-11-22(31)35-23-17(5)27(7,13-12-16(4)9-2)21-15-19(30)14-20-25(32)36-26(34-18(6)29)28(20,21)24(23)33-10-3/h9,12,14,17,19,21,23-26,30,32H,2,8,10-11,13,15H2,1,3-7H3

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ICYRBQHWTHLAOZ-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

ICYRBQHWTHLAOZ-UHFFFAOYSA-N

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