Desoxynigericin
group of stereoisomers with the chemical formula C₄₀H₆₈O₁₀
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Desoxynigericin
Summary
Desoxynigericin is a group of stereoisomers[1].
Key Facts
- Desoxynigericin's instance of is recorded as group of stereoisomers[2].
- Desoxynigericin's CAS Registry Number is recorded as 31357-58-1[3].
- Desoxynigericin's canonical SMILES is recorded as O=C(O)C(C)C1OC(CCC1C)CC2OC3(OC(C)(CC3C)C4OC(C)(CC4)C5OC(CC5C)C6OC(O)(C)C(C)CC6C)C(C)C(OC)C2[4].
- Desoxynigericin's InChI is recorded as InChI=1S/C40H68O10/c1-21-12-13-28(45-33(21)26(6)36(41)42)18-29-19-30(44-11)27(7)40(47-29)25(5)20-38(9,50-40)32-14-15-37(8,48-32)35-23(3)17-31(46-35)34-22(2)16-24(4)39(10,43)49-34/h21-35,43H,12-20H2,1-11H3,(H,41,42)/t21-,22-,23-,24+,25?,26?,27+,28+,29+,30+,31+,32?,33?,34-,35?,37?,38?,39-,40+/m0/s1[5].
- Desoxynigericin's InChIKey is recorded as ZITSQIZMRMDQLE-RHQSYKMPSA-N[6].
- Desoxynigericin's chemical formula is recorded as C₄₀H₆₈O₁₀[7].
- Desoxynigericin's subclass of is recorded as 2-[(3S,6R)-6-[[(5R,6R,7R,9R)-2-[5-[(3S)-5-[(3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-3-methyloxan-2-yl]propanoic acid[8].
- Desoxynigericin's PubChem CID is recorded as 35776[9].
- Desoxynigericin's found in taxon is recorded as Streptomyces griseus[10].
- Desoxynigericin's isomeric SMILES is recorded as CO[C@@H]1CC@@HO[C@]2(OC(C)(C3CCC(C)(C4OC@@HC[C@@H]4C)O3)CC2C)[C@@H]1CC@@HO[C@]2(OC(C)(C3CCC(C)(C4OC@@HC[C@@H]4C)O3)CC2C)[C@@H]1C">[11].
- Desoxynigericin's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+708.481248376'}[12].
- Desoxynigericin's SureChEMBL ID is recorded as 19717568[13].
- Desoxynigericin's DSSTox substance ID is recorded as DTXSID70953397[14].
- Desoxynigericin's DSSTOX compound identifier is recorded as DTXCID201381449[15].
- Desoxynigericin's UniChem compound ID is recorded as 46780591[16].