(Q105202333)

English

[(1R,4R,6R,7R,11S,12S,14R,17E)-17-ethylidene-4,14-dimethyl-10-methylidene-9,16-dioxo-5,8,15,18-tetraoxapentacyclo[9.6.1.01,14.04,6.07,11]octadecan-12-yl] 2-(hydroxymethyl)prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(17-Ethylidene-4,14-dimethyl-10-methylidene-9,16-dioxo-5,8,15,18-tetraoxapentacyclo[9.6.1.01,14.04,6.07,11]octadecan-12-yl) 2-(hydroxymethyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

446.157682412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₆O₉

0 references

canonical SMILES

O=C(OC1CC2(OC(=O)C(=CC)C32OC41C(=C)C(=O)OC4C5OC5(C)CC3)C)C(=C)CO

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isomeric SMILES

C=C(CO)C(=O)O[C@H]1C[C@@]2(C)OC(=O)/C(=C/C)[C@]23CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)C(=C)[C@]12O3

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found in taxon

Jeffreycia zanzibarensis

1 reference

stated in

Glaucolides from old world Vernonia species

Identifiers

InChI

InChI=1S/C23H26O9/c1-6-13-19(27)31-21(5)9-14(28-17(25)11(2)10-24)23-12(3)18(26)29-16(23)15-20(4,30-15)7-8-22(13,21)32-23/h6,14-16,24H,2-3,7-10H2,1,4-5H3/b13-6-/t14-,15+,16+,20+,21+,22+,23-/m0/s1

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InChIKey

OWVSJZMPMWDECG-GWTPSFAQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OWVSJZMPMWDECG-GWTPSFAQSA-N

(Q105202333)

[(1R,4R,6R,7R,11S,12S,14R,17E)-17-ethylidene-4,14-dimethyl-10-methylidene-9,16-dioxo-5,8,15,18-tetraoxapentacyclo[9.6.1.01,14.04,6.07,11]octadecan-12-yl] 2-(hydroxymethyl)prop-2-enoate

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Identifiers

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