Cinatrin A
[CAS# 136266-33-6]

Identification

• Name: Cinatrin A
• Synonyms: Cinatrin A; 1,7-Dioxaspiro(4.4)Nonane-4-Carboxylic Acid, 8-(9-Decenyl)-3,4-Dihydroxy-2,6-Dioxo-, (3R-(3Alpha,4Beta,5Beta(R*)))-; (3R,5R)-7-Dec-9-Enyl-3,4-Dihydroxy-2,9-Diketo-1,8-Dioxaspiro[4.4]Nonane-4-Carboxylic Acid
• Molecular Formula: C₁₈H₂₆O₈
• Molecular Weight: 370.40
• CAS Registry Number: 136266-33-6
• SMILES: [C@@]12(OC(=O)[C@H](O)C1(O)C(=O)O)C(OC(C2)CCCCCCCCC=C)=O
• InChI: 1S/C18H26O8/c1-2-3-4-5-6-7-8-9-10-12-11-17(16(23)25-12)18(24,15(21)22)13(19)14(20)26-17/h2,12-13,19,24H,1,3-11H2,(H,21,22)/t12?,13-,17-,18?/m0/s1
• InChIKey: ZFUPZDZSERSKNA-ZVRZEWSUSA-N

Properties

• Density: 1.323g/cm³ (Cal.)
• Boiling point: 593.982°C at 760 mmHg (Cal.)
• Flash point: 211.018°C (Cal.)