Aspinonene
chemical compound
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Aspinonene
Summary
Aspinonene is a group of stereoisomers[1].
Key Facts
- Aspinonene's instance of is recorded as group of stereoisomers[2].
- Aspinonene's CAS Registry Number is recorded as 157676-96-5[3].
- Aspinonene's canonical SMILES is recorded as OCC(O)(C=CC(O)C)C1OC1C[4].
- Aspinonene's InChI is recorded as InChI=1S/C9H16O4/c1-6(11)3-4-9(12,5-10)8-7(2)13-8/h3-4,6-8,10-12H,5H2,1-2H3/b4-3+/t6-,7-,8+,9?/m0/s1[5].
- Aspinonene's InChIKey is recorded as ZXCYAEKEHIEQHD-LHVSAYPMSA-N[6].
- Aspinonene's chemical formula is recorded as C₉H₁₆O₄[7].
- Aspinonene's subclass of is recorded as biogenic acyclic epoxide[8].
- Aspinonene's PubChem CID is recorded as 139585724[9].
- Aspinonene's ChEBI ID is recorded as 208869[10].
- Aspinonene's isomeric SMILES is recorded as CC@H/C=C/C(O)(CO)[C@@H]1O[C@H]1CC@H/C=C/C(O)(CO)[C@@H]1O[C@H]1C">[11].
- Aspinonene's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+188.104858992'}[12].
- Aspinonene's DSSTox substance ID is recorded as DTXSID00849597[13].
- Aspinonene's Natural Product Atlas ID is recorded as NPA009474[14].
- Aspinonene's DSSTOX compound identifier is recorded as DTXCID30800338[15].
- Aspinonene's UniChem compound ID is recorded as 170909048[16].