(Q105116398)

English

[(2R,5R)-5-hydroxy-2-[(S)-hydroxy-[(2R,3R)-2-methyl-3-[(Z,2S)-pent-3-en-2-yl]oxiran-2-yl]methyl]-4-methylidene-3,7-dioxononyl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[5-Hydroxy-2-[hydroxy-(2-methyl-3-pent-3-en-2-yloxiran-2-yl)methyl]-4-methylidene-3,7-dioxononyl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

396.214803364 dalton

1 reference

1 reference

[(2R,5S)-5-hydroxy-2-[(S)-hydroxy-[(2R,3R)-2-methyl-3-[(Z,2S)-pent-3-en-2-yl]oxiran-2-yl]methyl]-4-methylidene-3,7-dioxononyl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₂O₇

0 references

canonical SMILES

O=C(OCC(C(=O)C(=C)C(O)CC(=O)CC)C(O)C1(OC1C(C=CC)C)C)C

0 references

isomeric SMILES

C=C(C(=O)[C@H](COC(C)=O)[C@H](O)[C@@]1(C)O[C@@H]1[C@@H](C)/C=C\C)[C@H](O)CC(=O)CC

0 references

found in taxon

Myriapora truncata

1 reference

stated in

Myriaporones 1-4, cytotoxic metabolites from the Mediterranean bryozoan Myriapora truncata

Identifiers

InChI

InChI=1S/C21H32O7/c1-7-9-12(3)20-21(6,28-20)19(26)16(11-27-14(5)22)18(25)13(4)17(24)10-15(23)8-2/h7,9,12,16-17,19-20,24,26H,4,8,10-11H2,1-3,5-6H3/b9-7-/t12-,16-,17+,19-,20+,21+/m0/s1

0 references

InChIKey

INTXVVAAMVADFD-AGGXDOCGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

INTXVVAAMVADFD-AGGXDOCGSA-N

(Q105116398)

[(2R,5R)-5-hydroxy-2-[(S)-hydroxy-[(2R,3R)-2-methyl-3-[(Z,2S)-pent-3-en-2-yl]oxiran-2-yl]methyl]-4-methylidene-3,7-dioxononyl] acetate

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Identifiers

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