(Q105287740)

English

[(E)-2-[(1S,4S,8R,10S,11S,13S)-8-hydroxy-1,5,5-trimethyl-9-oxo-10-(2-oxopropyl)-6-oxatricyclo[6.3.2.04,13]tridecan-11-yl]ethenyl] 3-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-[8-Hydroxy-1,5,5-trimethyl-9-oxo-10-(2-oxopropyl)-6-oxatricyclo[6.3.2.04,13]tridecan-11-yl]ethenyl 3-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

432.251188872 dalton

1 reference

1 reference

C₂₅H₃₆O₆

0 references

canonical SMILES

O=C(OC=CC1C(C(=O)C2(O)COC(C)(C)C3CCC1(C)CC32)CC(=O)C)C=C(C)C

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isomeric SMILES

CC(=O)C[C@@H]1C(=O)[C@]2(O)COC(C)(C)[C@H]3CC[C@@](C)(C[C@@H]32)[C@H]1/C=C/OC(=O)C=C(C)C

0 references

found in taxon

Viburnum odoratissimum var. awabuki

1 reference

stated in

Chemical conversion of vibsanin C to vibsanin E and structure of 3-hydroxyvibsanin E from viburnum awabuki

Identifiers

InChI

InChI=1S/C25H36O6/c1-15(2)11-21(27)30-10-8-18-17(12-16(3)26)22(28)25(29)14-31-23(4,5)19-7-9-24(18,6)13-20(19)25/h8,10-11,17-20,29H,7,9,12-14H2,1-6H3/b10-8+/t17-,18-,19-,20-,24-,25-/m0/s1

0 references

InChIKey

VKHACZXOCHJKOR-JPMDGQIOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VKHACZXOCHJKOR-JPMDGQIOSA-N

(Q105287740)

[(E)-2-[(1S,4S,8R,10S,11S,13S)-8-hydroxy-1,5,5-trimethyl-9-oxo-10-(2-oxopropyl)-6-oxatricyclo[6.3.2.04,13]tridecan-11-yl]ethenyl] 3-methylbut-2-enoate

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Identifiers

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