(Q105292131)

English

garcinielliptone M

chemical compound

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instance of

type of chemical entity

0 references

subclass of

4-(2-Hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

1 reference

based on heuristic

inferred from SMILES

mass

484.318874508 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,4S,8S,10S)-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,4R,8S,10S)-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,4R,8R,10R)-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,4R,8S,10R)-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

1 reference

based on heuristic

inferred from InChI

(1R,4S,8S,10R)-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-8,10-bis(3-methylbut-2-enyl)-1-(2-methylpropanoyl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₄O₅

0 references

canonical SMILES

O=C1C2=C(OC(C2)C(O)(C)C)C3(C(=O)C(C)C)C(=O)C1(CC=C(C)C)C(C)(C)C(CC=C(C)C)C3

0 references

isomeric SMILES

CC(C)=CC[C@H]1C[C@]2(C(=O)C(C)C)C(=O)[C@@](CC=C(C)C)(C(=O)C3=C2O[C@H](C(C)(C)O)C3)C1(C)C

0 references

found in taxon

Garcinia subelliptica

2 references

stated in

Anti-inflammatory phloroglucinols and terpenoids from Garcinia subelliptica

stated in

Anti-inflammatory Phloroglucinols and Terpenoids from Garcinia subelliptica

Identifiers

InChI

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

0 references

InChIKey

VSDIWXQPEDKOLG-BGMSEKPMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VSDIWXQPEDKOLG-BGMSEKPMSA-N

1 reference

(Q105292131)

garcinielliptone M

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