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Substance Name: Sanguiin H-2
RN: 82200-04-2
InChIKey: MZUSVKVKDSKMEX-UHFFFAOYSA-N

Molecular Formula

  • C48-H32-O31

Molecular Weight

  • 1104.7498
 
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Names and Synonyms

Results Name

  • Sanguiin H-2

Synonym

  • Sanguiin H-2

Systematic Name

  • alpha-D-Glucopyranose, cyclic 3,6-(3-(5-carboxy-2,3-dihydroxyphenoxy)-4,4',5,5'.6.6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) cyclic 2,4-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 1-(3,4,5-trihydroxybenzoate), stereoisomer

Registry Numbers

CAS Registry Number

  • 82200-04-2

System Generated Number

  • 0082200042

Structure Descriptors

InChI

1S/C48H32O31/c49-8-21-37-35(63)40(78-47(72)13-7-17(53)30(58)33(61)24(13)23-12(46(71)77-37)6-16(52)29(57)32(23)60)48(75-21)79-45(70)10-2-18(54)36-20(4-10)74-41-38(73-19-3-9(42(64)65)1-14(50)27(19)55)26(44(68)69)25(34(62)39(41)76-36)22-11(43(66)67)5-15(51)28(56)31(22)59/h1-7,21,35,37,40,48-63H,8H2,(H,64,65)(H,66,67)(H,68,69)

InChIKey

MZUSVKVKDSKMEX-UHFFFAOYSA-N

Smiles

c1c(cc2c(c1O)Oc3c(c(c(c(c3O2)Oc4cc(cc(c4O)O)C(=O)O)C(=O)O)c5c(cc(c(c5O)O)O)C(=O)O)O)C(=O)OC6C7C(C(C(O6)CO)OC(=O)c8cc(c(c(c8-c9c(cc(c(c9O)O)O)C(=O)O7)O)O)O)O