(2Z,4aS,12aR)-2-(Amino-Hydroxymethylidene)-4a,10,11,12a-Tetrahydroxy-8-Methoxy-4,5-Dihydrotetracene-1,3,12-Trione
[CAS# 148084-40-6]

Identification

• Name: (2Z,4aS,12aR)-2-(Amino-Hydroxymethylidene)-4a,10,11,12a-Tetrahydroxy-8-Methoxy-4,5-Dihydrotetracene-1,3,12-Trione
• Synonyms: (2Z,4As,12Ar)-2-(Amino-Hydroxy-Methylene)-4A,10,11,12A-Tetrahydroxy-8-Methoxy-4,5-Dihydrotetracene-1,3,12-Trione; (2Z,4As,12Ar)-2-(Amino-Hydroxymethylene)-4A,10,11,12A-Tetrahydroxy-8-Methoxy-4,5-Dihydrotetracene-1,3,12-Trione; (2Z,4As,12Ar)-2-(Amino-Hydroxy-Methylidene)-4A,10,11,12A-Tetrahydroxy-8-Methoxy-4,5-Dihydrotetracene-1,3,12-Trione
• Molecular Formula: C₂₀H₁₇NO₉
• Molecular Weight: 415.36
• CAS Registry Number: 148084-40-6
• SMILES: [C@@]34(O)[C@@](O)(C(=O)C2=C(O)C1=C(O)C=C(OC)C=C1C=C2C3)C(=O)\C(C(=O)C4)=C(/O)N
• InChI: 1S/C20H17NO9/c1-30-9-3-7-2-8-5-19(28)6-11(23)14(18(21)27)17(26)20(19,29)16(25)13(8)15(24)12(7)10(22)4-9/h2-4,22,24,27-29H,5-6,21H2,1H3/b18-14-/t19-,20+/m0/s1
• InChIKey: WMENTGZRTZXFDF-ZDGFMGGXSA-N

Properties

• Density: 1.836g/cm³ (Cal.)
• Boiling point: 625.741°C at 760 mmHg (Cal.)
• Flash point: 332.236°C (Cal.)