(Q105280653)

English

(1S,3R,8R,10S)-3-(2-hydroxypropan-2-yl)-9,9-dimethyl-6,10-bis(3-methylbut-2-enyl)-8-(2-methylpropanoyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-(2-Hydroxypropan-2-yl)-9,9-dimethyl-6,10-bis(3-methylbut-2-enyl)-8-(2-methylpropanoyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione

1 reference

based on heuristic

inferred from SMILES

mass

484.318874508 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₄O₅

0 references

canonical SMILES

O=C1C(=C2OC(CC23C(=O)C1(C(=O)C(C)C)C(C)(C)C(CC=C(C)C)C3)C(O)(C)C)CC=C(C)C

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isomeric SMILES

CC(C)=CCC1=C2O[C@@H](C(C)(C)O)C[C@@]23C[C@H](CC=C(C)C)C(C)(C)[C@@](C(=O)C(C)C)(C1=O)C3=O

0 references

found in taxon

Garcinia subelliptica

1 reference

stated in

Novel and Anti‐Inflammatory Constituents of Garcinia subelliptica

Identifiers

InChI

InChI=1S/C30H44O5/c1-17(2)11-13-20-15-29-16-22(28(9,10)34)35-25(29)21(14-12-18(3)4)24(32)30(26(29)33,27(20,7)8)23(31)19(5)6/h11-12,19-20,22,34H,13-16H2,1-10H3/t20-,22+,29-,30-/m0/s1

0 references

InChIKey

UWZUPSXSBAFYHU-MBDCOTJVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UWZUPSXSBAFYHU-MBDCOTJVSA-N

(Q105280653)

(1S,3R,8R,10S)-3-(2-hydroxypropan-2-yl)-9,9-dimethyl-6,10-bis(3-methylbut-2-enyl)-8-(2-methylpropanoyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione

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Identifiers

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