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Substance Name: Hemocorin
RN: 11034-94-9
InChIKey: FNZZYRONWCJZTM-CXWOCMNWSA-N

Molecular Formula

  • C32-H34-O14

Molecular Weight

  • 642.607
 
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Names and Synonyms

Name of Substance

  • Hemocorin

Synonym

  • Haemocorin

Systematic Name

  • 1H-Phenalen-1-one, 6-((4-O-beta-D-glucopyranosyl-D-glucopyranosyl)oxy)-2-hydroxy-5-methoxy-9-phenyl-

Registry Numbers

CAS Registry Number

  • 11034-94-9

Other Registry Numbers

  • 20559-12-0
  • 33404-39-6

System Generated Number

  • 0011034949

Structure Descriptors

InChI

1S/C32H34O14/c1-42-17-9-14-10-18(24(36)22-15(13-5-3-2-4-6-13)7-8-16(21(14)22)23(17)35)43-31-29(41)27(39)30(20(12-34)45-31)46-32-28(40)26(38)25(37)19(11-33)44-32/h2-10,19-20,25-35,37-41H,11-12H2,1H3/t19-,20-,25-,26+,27-,28-,29-,30-,31-,32+/m1/s1

InChIKey

FNZZYRONWCJZTM-CXWOCMNWSA-N

Smiles

C1(C(=Cc2cc(c(c3ccc(c1c23)c1ccccc1)O)OC)O[C@H]1[C@H](O)[C@@H](O)[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@H](O2)CO)[C@H](O1)CO)=O