| more general categories |
information about this item |
|
| 06. Name of Biological Source of Chemical |
 |
 |
|
06. Name of Biological Source of Chemical |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
Brucea javanica (6) |
|
 |
| 07. Part of Biological Source of Chemical |
 |
 |
|
07. Part of Biological Source of Chemical |
|
|
|
|
|
|
|
fruit [PO:0009001] (81) |
|
 |
| 08. Chemical Category |
 |
 |
|
08. Chemical Category |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
3,15-di-O-acetylbruceolide [CHEBI:65532] (1) |
|
 |
| ChEBI Compound Accession Identifier: |
[CHEBI:65532] |
| ChEBI Compound Description: |
null |
| ChEBI Compound Identification Number: |
65532 |
| ChEBI InChI Value: |
InChI=1S/C25H30O12/c1-9-12-6-14-24-8-34-25(22(32)33-5,19(24)17(21(31)37-14)36-11(3)27)20(30)15(29)18(24)23(12,4)7-13(28)16(9)35-10(2)26/h12,14-15,17-20,29-30H,6-8H2,1-5H3/t12-,14+,15+,17+,18+,19+,20-,23-,24+,25+/m0/s1 |
| ChEBI InChIKey Value: |
ZDBJNNBVIRSCJN-LFVFYYESSA-N |
| ChEBI Compound Name: |
3,15-di-O-acetylbruceolide |
| ChEBI SMILES Value: |
[H][C@@]12C[C@@]3([H])C(C)=C(OC(C)=O)C(=O)C[C@]3(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@@]4(OC[C@@]13[C@@]4([H])[C@@H](OC(C)=O)C(=O)O2)C(=O)OC |
| ChEBI Substance ID: |
160709405 |
| ChEBI URL: |
ChEBI:65532 |
| ChemSpider ID: |
NS |
| Ontomatica Chemical Accession Key (OnChAKey): |
ZDBJNNBVIRSCJN_LFVFYYESSA_N_000_000000 |
| PubChem Compound ID: |
70697720 |