| Identification | Back Directory | [Name]
PalMaruMycin C3 | [CAS]
159934-11-9 | [Synonyms]
PalMaruMycin C3
(1aR,7aS)-1a,7a-Dihydro-3,6-dihydroxy-spiro[naphth[2,3-b]oxirene-2(7H),2'-naphtho[1,8-de][1,3]dioxin]-7-one
Spiro[naphth[2,3-b]oxirene-2(7H),2'-naphtho[1,8-de][1,3]dioxin]-7-one, 1a,7a-dihydro-3,6-dihydroxy-, (1aR,7aS)- | [Molecular Formula]
C20H12O6 | [MOL File]
159934-11-9.mol | [Molecular Weight]
348.31 |
| Chemical Properties | Back Directory | [Boiling point ]
715.2±60.0 °C(Predicted) | [density ]
1.71±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C | [form ]
A solid | [pka]
8.18±0.20(Predicted) | [color ]
Yellow to green | [InChI]
InChI=1S/C20H12O6/c21-10-7-8-11(22)16-15(10)17(23)18-19(24-18)20(16)25-12-5-1-3-9-4-2-6-13(26-20)14(9)12/h1-8,18-19,21-22H/t18-,19-/m1/s1 | [InChIKey]
BDXBHYOFNNANPN-RTBURBONSA-N | [SMILES]
O1[C@]2([H])C(=O)C3=C(C4(OC5=CC=CC6=C5C(=CC=C6)O4)[C@]12[H])C(O)=CC=C3O |
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