(Q105000392)

English

[4-(2,3-Dimethylbutanoyloxy)-5,6-dihydroxy-3,7,11,14-tetramethyl-15-oxo-11-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl benzoate

group of stereoisomers with the chemical formula C₃₃H₄₂O₇

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Statements

group of stereoisomers

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ingenane diterpenoid

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ingenane diterpenoid

550.2930536839998 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₃H₄₂O₇

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canonical SMILES

O=C(OCC1(C)C2CC(C)C34C=C(C)C(OC(=O)C(C)C(C)C)C4(O)C(O)C(=CC(C3=O)C21)C)C=5C=CC=CC5

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Identifiers

InChI=1S/C33H42O7/c1-17(2)21(6)29(36)40-28-19(4)15-32-20(5)14-24-25(23(27(32)35)13-18(3)26(34)33(28,32)38)31(24,7)16-39-30(37)22-11-9-8-10-12-22/h8-13,15,17,20-21,23-26,28,34,38H,14,16H2,1-7H3

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FRRIZFCLGOVTAU-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

FRRIZFCLGOVTAU-UHFFFAOYSA-N

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