8-Hexanoylneosolaniol
group of stereoisomers with the chemical formula C₂₅H₃₆O₉
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8-Hexanoylneosolaniol
Summary
8-Hexanoylneosolaniol is a group of stereoisomers[1].
Key Facts
- 8-Hexanoylneosolaniol's instance of is recorded as group of stereoisomers[2].
- 8-Hexanoylneosolaniol's CAS Registry Number is recorded as 118143-01-4[3].
- 8-Hexanoylneosolaniol's canonical SMILES is recorded as O=C(OCC12CC(OC(=O)CCCCC)C(=CC2OC3C(O)C(OC(=O)C)C1(C)C43OC4)C)C[4].
- 8-Hexanoylneosolaniol's InChI is recorded as InChI=1S/C25H36O9/c1-6-7-8-9-19(28)33-17-11-24(12-30-15(3)26)18(10-14(17)2)34-22-20(29)21(32-16(4)27)23(24,5)25(22)13-31-25/h10,17-18,20-22,29H,6-9,11-13H2,1-5H3/t17-,18+,20+,21+,22+,23+,24+,25?/m0/s1[5].
- 8-Hexanoylneosolaniol's InChIKey is recorded as NTQOBLPQKXJXCZ-BFAIXHJHSA-N[6].
- 8-Hexanoylneosolaniol's chemical formula is recorded as C₂₅H₃₆O₉[7].
- 8-Hexanoylneosolaniol's subclass of is recorded as trichothecane sesquiterpenoid[8].
- 8-Hexanoylneosolaniol's PubChem CID is recorded as 3081149[9].
- 8-Hexanoylneosolaniol's ChEBI ID is recorded as 175768[10].
- 8-Hexanoylneosolaniol's found in taxon is recorded as Fusarium sporotrichioides[11].
- 8-Hexanoylneosolaniol's isomeric SMILES is recorded as CCCCCC(=O)O[C@H]1C[C@@]2(COC(C)=O)C@@HO[C@@H]1C@HC@@H[C@@]2(C)C12CO2C@@HO[C@@H]1C@HC@@H[C@@]2(C)C12CO2">[12].
- 8-Hexanoylneosolaniol's KNApSAcK ID is recorded as C00056574[13].
- 8-Hexanoylneosolaniol's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+480.23593273199987'}[14].
- 8-Hexanoylneosolaniol's SureChEMBL ID is recorded as 31570931[15].
- 8-Hexanoylneosolaniol's DSSTox substance ID is recorded as DTXSID20922614[16].
- 8-Hexanoylneosolaniol's DSSTOX compound identifier is recorded as DTXCID501351495[17].
- 8-Hexanoylneosolaniol's UniChem compound ID is recorded as 48547753[18].