(Q104912045)

English

(1R,4S,6R,7E,11S,12R)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

chemical compound

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type of chemical entity

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subclass of

(4R,6S,7E,11R)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.0⁴,⁶.0¹³,¹⁸]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

1 reference

1 reference

14,16-Dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

454.271924316 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,4R,6R,7E,11R,12S)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

2 references

based on heuristic

inferred from InChIKey

1 reference

(1S,4R,6S,7E,11R,12R)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

1 reference

based on heuristic

inferred from InChI

(1S,4R,6S,7E,11R,12S)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₈O₅

0 references

canonical SMILES

O=CC=1C(O)=C(C=O)C=2OC3(C)CCC4C(C=C(C)CCC3C(C2C1O)CC(C)C)C4(C)C

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isomeric SMILES

C/C1=C\[C@@H]2[C@H](CC[C@@]3(C)Oc4c(C=O)c(O)c(C=O)c(O)c4[C@H](CC(C)C)[C@@H]3CC1)C2(C)C

0 references

found in taxon

Eucalyptus globulus

1 reference

stated in

The granulation-inhibiting principles from Eucalyptus globulus Labill. III. The structures of euglobal-III,-IVb and -VII.

Identifiers

InChI

InChI=1S/C28H38O5/c1-15(2)11-17-20-8-7-16(3)12-22-21(27(22,4)5)9-10-28(20,6)33-26-19(14-30)24(31)18(13-29)25(32)23(17)26/h12-15,17,20-22,31-32H,7-11H2,1-6H3/b16-12+/t17-,20+,21+,22-,28-/m1/s1

0 references

InChIKey

AGTXIGWLMDUUMQ-UFHZQYFQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AGTXIGWLMDUUMQ-UFHZQYFQSA-N

(Q104912045)

(1R,4S,6R,7E,11S,12R)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde

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