(Q104963169)

English

[(1R,2S,4S,7S,9R,10E,13R,15S,16S)-13-acetyloxy-4,8,8,11,15-pentamethyl-12-oxo-3-oxatetracyclo[11.3.0.02,4.07,9]hexadec-10-en-16-yl] 2-methylpropanoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

(13-Acetyloxy-4,8,8,11,15-pentamethyl-12-oxo-3-oxatetracyclo[11.3.0.02,4.07,9]hexadec-10-en-16-yl) 2-methylpropanoate

1 reference

based on heuristic

inferred from SMILES

mass

446.266838936 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₈O₆

0 references

canonical SMILES

O=C(OC12C(=O)C(=CC3C(CCC4(OC4C2C(OC(=O)C(C)C)C(C)C1)C)C3(C)C)C)C

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isomeric SMILES

CC(=O)O[C@]12C[C@H](C)[C@H](OC(=O)C(C)C)[C@@H]1[C@@H]1O[C@@]1(C)CC[C@H]1[C@@H](/C=C(\C)C2=O)C1(C)C

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found in taxon

Euphorbia characias

1 reference

stated in

Lathyrane type diterpenoid esters from Euphorbia characias

Identifiers

InChI

InChI=1S/C26H38O6/c1-13(2)23(29)30-20-15(4)12-26(31-16(5)27)19(20)22-25(8,32-22)10-9-17-18(24(17,6)7)11-14(3)21(26)28/h11,13,15,17-20,22H,9-10,12H2,1-8H3/b14-11+/t15-,17-,18+,19+,20-,22-,25-,26+/m0/s1

0 references

InChIKey

CLBNVMAQWXNMGF-PKBRFECASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CLBNVMAQWXNMGF-PKBRFECASA-N

(Q104963169)

[(1R,2S,4S,7S,9R,10E,13R,15S,16S)-13-acetyloxy-4,8,8,11,15-pentamethyl-12-oxo-3-oxatetracyclo[11.3.0.02,4.07,9]hexadec-10-en-16-yl] 2-methylpropanoate

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Identifiers

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