(Q105360896)

English

[(1S,2R,6R,10R,11S,13S,14R,15R)-13-acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl (9Z,12Z)-octadeca-9,12-dienoate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

(13-Acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl)methyl octadeca-9,12-dienoate

1 reference

based on heuristic

inferred from SMILES

mass

668.42881888 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

13-O-Acetylphorbol-20-(9Z,12Z)-octadecadienoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl octadeca-9,12-dienoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₀H₆₀O₈

0 references

canonical SMILES

O=C(OC12C(O)C(C)C3(O)C(C=C(COC(=O)CCCCCCCC=CCC=CCCCCC)CC4(O)C(=O)C(=CC43)C)C1C2(C)C)C

0 references

isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC1=C[C@@H]2[C@H]3C(C)(C)[C@]3(OC(C)=O)[C@H](O)[C@@H](C)[C@]2(O)[C@H]2C=C(C)C(=O)[C@@]2(O)C1

0 references

found in taxon

Croton tiglium

1 reference

stated in

Anti-HIV-1 phorbol esters from the seeds of Croton tiglium

Identifiers

InChI

InChI=1S/C40H60O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-33(42)47-26-30-24-31-34-37(5,6)40(34,48-29(4)41)36(44)28(3)39(31,46)32-23-27(2)35(43)38(32,45)25-30/h11-12,14-15,23-24,28,31-32,34,36,44-46H,7-10,13,16-22,25-26H2,1-6H3/b12-11-,15-14-/t28-,31-,32+,34+,36-,38-,39-,40-/m1/s1

0 references

InChIKey

YSXDURFMHDUCMP-DWXACDDLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YSXDURFMHDUCMP-DWXACDDLSA-N

(Q105360896)

[(1S,2R,6R,10R,11S,13S,14R,15R)-13-acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl (9Z,12Z)-octadeca-9,12-dienoate

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)