Sorocein A
[CAS# 137460-77-6]

Identification

• Name: Sorocein A
• Synonyms: 3Ah-Benzo(3,4)(2)Benzopyrano(1,8-Bc)(1)Benzopyran-4,11-Diol, 6-(2-(2,4-Dihydroxyphenyl)Ethenyl)-1,8A,13B,13C-Tetrahydro-8A-(5-Hydroxy-2,2-Dimethyl-2H-1-Benzopyran-8-Yl)-2-Methyl-
• Molecular Formula: C₃₉H₃₄O₈
• Molecular Weight: 630.69
• CAS Registry Number: 137460-77-6
• SMILES: C7=C(C24OC1=CC(=CC(=C1C5C2C(C3=CC=C(O)C=C3O4)CC(=C5)C)O)\C=C\C6=C(O)C=C(O)C=C6)C8=C(C(=C7)O)C=CC(O8)(C)C
• InChI: 1S/C39H34O8/c1-20-14-27-25-9-8-24(41)19-33(25)45-39(29-10-11-30(42)26-12-13-38(2,3)47-37(26)29)36(27)28(15-20)35-32(44)16-21(17-34(35)46-39)4-5-22-6-7-23(40)18-31(22)43/h4-13,15-19,27-28,36,40-44H,14H2,1-3H3/b5-4+
• InChIKey: YSIMPAVIBIIDOC-SNAWJCMRSA-N

Properties

• Density: 1.403g/cm³ (Cal.)
• Boiling point: 814.634°C at 760 mmHg (Cal.)
• Flash point: 446.474°C (Cal.)