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Substance Name: Camelliatannin H
RN: 148159-86-8
InChIKey: MSRCJTQIFIFKEZ-UHFFFAOYSA-N

Note

  • Isolated from the leaves and flower buds of Camellia japonica.

Molecular Weight

  • 1567.111
 
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Names and Synonyms

Name of Substance

  • Camelliatannin H

Systematic Name

  • D-Glucose, cyclic 2->2:3->2'-(4-(6-carboxy-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) cyclic 4,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate), 2-ester with D-glucose cyclic 4,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 3-(3,4,5-trihydroxybenzoate), (2(S(S)),4(S))-

Registry Numbers

CAS Registry Number

  • 148159-86-8

System Generated Number

  • 0148159868

Structure Descriptors

InChI

1S/C69H50O43/c70-22-8-21-56(57-32(106-67(21)100)11-103-62(95)15-3-25(73)41(80)48(87)35(15)38-18(65(98)109-57)6-28(76)44(83)51(38)90)108-64(97)17-5-27(75)43(82)50(89)37(17)34-14(22)10-31(47(86)53(34)92)105-55-20(9-30(78)46(85)54(55)93)68(101)112-60-59(111-61(94)13-1-23(71)40(79)24(72)2-13)58-33(107-69(60)102)12-104-63(96)16-4-26(74)42(81)49(88)36(16)39-19(66(99)110-58)7-29(77)45(84)52(39)91/h1-7,9-10,21,32-33,56-60,67,69,71-93,100,102H,8,11-12H2

InChIKey

MSRCJTQIFIFKEZ-UHFFFAOYSA-N

Smiles

c1c(cc(c(c1O)O)O)C(=O)OC2C3C(COC(=O)c4cc(c(c(c4-c5c(cc(c(c5O)O)O)C(=O)O3)O)O)O)OC(C2OC(=O)c6cc(c(c(c6Oc7cc8c(c(c7O)O)-c9c(cc(c(c9O)O)O)C(=O)OC1C(CC8=O)C(OC2C1OC(=O)c1cc(c(c(c1-c1c(cc(c(c1O)O)O)C(=O)OC2)O)O)O)O)O)O)O)O