166020-15-1 (3,3',4',5,7-五羟基黄烷-(4→8) -3,3',4',5,7-五羟基黄烷;(2S,2'S,3S,3'S,4β)-,3,3'-双-O-(3,4,5-三羟基苯甲酰基),3,3',4',5,7-Pentahydroxyflavan-(4→8)-3,3',4',5,7-pentahydroxyflavan; (2S,2'S,3S,3'S,4β)-form, 3,3'-Bis-O-(3,4,5-trihydroxybenzoyl))

CAS号:
166020-15-1
中文名称:
3,3',4',5,7-五羟基黄烷-(4→8) -3,3',4',5,7-五羟基黄烷;(2S,2'S,3S,3'S,4β)-,3,3'-双-O-(3,4,5-三羟基苯甲酰基)
英文名称:
3,3',4',5,7-Pentahydroxyflavan-(4→8)-3,3',4',5,7-pentahydroxyflavan; (2S,2'S,3S,3'S,4β)-form, 3,3'-Bis-O-(3,4,5-trihydroxybenzoyl)
分子式:
C44H34O20
分子量:
882.728774547577
植物源:

3,3',4',5,7-五羟基黄烷-(4→8) -3,3',4',5,7-五羟基黄烷;(2S,2'S,3S,3'S,4β)-,3,3'-双-O-(3,4,5-三羟基苯甲酰基)(166020-15-1)名称与标识符

标识符

InChIKey:
KTLUHRSHFRODPS-UHFFFAOYSA-N
Inchi:
1S/C44H34O20/c45-19-11-26(51)34-32(12-19)61-40(16-2-4-22(47)25(50)6-16)42(64-44(60)18-9-30(55)38(58)31(56)10-18)36(34)35-27(52)14-23(48)20-13-33(62-43(59)17-7-28(53)37(57)29(54)8-17)39(63-41(20)35)15-1-3-21(46)24(49)5-15/h1-12,14,33,36,39-40,42,45-58H,13H2
SMILES:
OC1C=C2C(C(C3C4=C(CC(C(C5C=C(O)C(O)=CC=5)O4)OC(C4C=C(O)C(O)=C(O)C=4)=O)C(O)=CC=3O)C(C(C3C=C(O)C(O)=CC=3)O2)OC(C2C=C(O)C(O)=C(O)C=2)=O)=C(O)C=1