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Substance Name: Euphorbin H
RN: 143201-48-3
InChIKey: WDWBAQMVBNTSLS-UHFFFAOYSA-N

Molecular Formula

  • C68-H50-O44

Molecular Weight

  • 1571.099
 
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Names and Synonyms

Results Name

  • Euphorbin H

Synonym

  • Euphorbin H

Systematic Name

  • beta-D-Glucopyranose, cyclic 3-2':6-2-((1R)-4-(6-(((4,6-O-(((1S)-4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-diyl)dicarbonyl)-2,3-bis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranosyl)oxy)carbonyl)-2,3,4-trihydroxyphenoxy)-4',5,5',6,6'-pentahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 1-(3,4,5-trihydroxybenzoate)

Registry Numbers

CAS Registry Number

  • 143201-48-3

System Generated Number

  • 0143201483

Structure Descriptors

InChI

1S/C68H50O44/c69-22-1-14(2-23(70)39(22)79)59(94)109-57-55-34(13-103-62(97)17-7-28(75)42(82)48(88)35(17)36-18(64(99)107-55)8-29(76)43(83)49(36)89)106-68(58(57)110-60(95)15-3-24(71)40(80)25(72)4-15)112-66(101)21-10-31(78)45(85)52(92)54(21)104-32-11-20-38(51(91)46(32)86)37-19(9-30(77)44(84)50(37)90)65(100)108-56-47(87)33(12-102-63(20)98)105-67(53(56)93)111-61(96)16-5-26(73)41(81)27(74)6-16/h1-11,33-34,47,53,55-58,67-93H,12-13H2

InChIKey

WDWBAQMVBNTSLS-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(c6)O)O)O)OC(=O)c7cc(c(c(c7Oc8cc9c(c(c8O)O)-c1c(cc(c(c1O)O)O)C(=O)OC1C(C(COC9=O)OC(C1O)OC(=O)c1cc(c(c(c1)O)O)O)O)O)O)O