(1aS-(1aalpha,2abeta,6alpha,6abeta,7aalpha))-6-hydroxy-Spiro(2a,6a-epoxynaphth(2,3-b)oxirene-2(1aH),2'-naphtho(1,8-de)(1,3)dioxin)-3,7(6H,7aH)-dione
[CAS# 152697-41-1]

Identification

• Name: (1aS-(1aalpha,2abeta,6alpha,6abeta,7aalpha))-6-hydroxy-Spiro(2a,6a-epoxynaphth(2,3-b)oxirene-2(1aH),2'-naphtho(1,8-de)(1,3)dioxin)-3,7(6H,7aH)-dione
• Synonyms: Sch-49209; Spiro(2A,6A-Epoxynaphth(2,3-B)Oxirene-2(1Ah),2'-Naphtho(1,8-De)(1,3)Dioxin)-3,7(6H,7Ah)-Dione, 6-Hydroxy-, (1As-(1Aalpha,2Abeta,6Alpha,6Abeta,7Aalpha))-
• Molecular Formula: C₂₀H₁₂O₇
• Molecular Weight: 364.31
• CAS Registry Number: 152697-41-1
• SMILES: [C@@H]13O[C@@H]1C(C27[C@H](C=CC(C2(C36OC4=CC=CC5=C4C(=CC=C5)O6)O7)=O)O)=O
• InChI: 1S/C20H12O7/c21-12-7-8-13(22)19-18(12,27-19)16(23)15-17(24-15)20(19)25-10-5-1-3-9-4-2-6-11(26-20)14(9)10/h1-8,12,15,17,21H/t12-,15+,17+,18?,19?/m0/s1
• InChIKey: HYDQYYPALJMCCU-IBOFRUOLSA-N

Properties

• Density: 1.776g/cm³ (Cal.)
• Boiling point: 755.16°C at 760 mmHg (Cal.)
• Flash point: 283.337°C (Cal.)