(Q105153145)

English

[(1S,2S,3aR,5R,6E,9S,10S,11S,13R,13aR)-9,13-diacetyloxy-3a,5,10-trihydroxy-2,5,8,8-tetramethyl-11-[(Z)-2-methylbut-2-enoyl]oxy-12-methylidene-4-oxo-1,2,3,9,10,11,13,13a-octahydrocyclopenta[12]annulen-1-yl] (3S)-3-hydroperoxy-2-methylidenebutanoate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

1 reference

[9,13-Diacetyloxy-3a,5,10-trihydroxy-2,5,8,8-tetramethyl-11-(2-methylbut-2-enoyloxy)-12-methylidene-4-oxo-1,2,3,9,10,11,13,13a-octahydrocyclopenta[12]annulen-1-yl] 3-hydroperoxy-2-methylidenebutanoate

1 reference

based on heuristic

inferred from SMILES

mass

680.304406216 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₄₈O₁₄

0 references

canonical SMILES

O=C(OC1C(=C)C(OC(=O)C)C2C(OC(=O)C(=C)C(OO)C)C(C)CC2(O)C(=O)C(O)(C=CC(C)(C)C(OC(=O)C)C1O)C)C(=CC)C

0 references

isomeric SMILES

C=C(C(=O)O[C@H]1[C@@H](C)C[C@]2(O)C(=O)[C@](C)(O)/C=C/C(C)(C)[C@H](OC(C)=O)[C@H](O)[C@@H](OC(=O)/C(C)=C\C)C(=C)[C@H](OC(C)=O)[C@@H]12)[C@H](C)OO

0 references

found in taxon

Euphorbia amygdaloides

1 reference

stated in

Amygdaloidins A–L, twelve new 13 α-OH jatrophane diterpenes from Euphorbia amygdaloides L.

Identifiers

InChI

InChI=1S/C34H48O14/c1-12-16(2)29(38)47-27-19(5)26(44-21(7)35)23-25(46-30(39)18(4)20(6)48-43)17(3)15-34(23,42)31(40)33(11,41)14-13-32(9,10)28(24(27)37)45-22(8)36/h12-14,17,20,23-28,37,41-43H,4-5,15H2,1-3,6-11H3/b14-13+,16-12-/t17-,20-,23+,24+,25-,26-,27-,28+,33+,34+/m0/s1

0 references

InChIKey

LKMPZWITWFXSHR-ZKUREMDOSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105153145)

[(1S,2S,3aR,5R,6E,9S,10S,11S,13R,13aR)-9,13-diacetyloxy-3a,5,10-trihydroxy-2,5,8,8-tetramethyl-11-[(Z)-2-methylbut-2-enoyl]oxy-12-methylidene-4-oxo-1,2,3,9,10,11,13,13a-octahydrocyclopenta[12]annulen-1-yl] (3S)-3-hydroperoxy-2-methylidenebutanoate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)