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Substance Name: Zaragozic acid E
RN: 151990-70-4
UNII: BTV2R9I8D4
InChIKey: HPNWHOBVFZEFCZ-IMGBLTPTSA-N

Molecular Formula

  • C40-H50-O12

Molecular Weight

  • 722.823
 
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Names and Synonyms

Name of Substance

  • Zaragozic acid E

Synonyms

  • L-Glycero-D-altro-tridec-10-en-7-ulo-7,4-furanosonic acid, 2,7-anhydro-3,4-di-c-carboxy-8,9,10,11,12,13-hexadeoxy-12-(3-phenylpropyl)-, 5-((4E)-6-methyl-9-phenyl-4-nonenoate), (7S,10E,12xi)-
  • UNII-BTV2R9I8D4
  • Zaragozic acid E

Registry Numbers

CAS Registry Number

  • 151990-70-4

FDA UNII

  • BTV2R9I8D4

System Generated Number

  • 0151990704

Structure Descriptors

InChI

1S/C40H50O12/c1-27(17-13-23-29-19-5-3-6-20-29)15-9-10-25-31(41)50-33-32(42)38(26-12-11-16-28(2)18-14-24-30-21-7-4-8-22-30)51-34(35(43)44)39(49,36(45)46)40(33,52-38)37(47)48/h3-9,11,15-16,19-22,27-28,32-34,42,49H,10,12-14,17-18,23-26H2,1-2H3,(H,43,44)(H,45,46)(H,47,48)/b15-9+,16-11+/t27-,28-,32+,33+,34+,38-,39+,40-/m0/s1

InChIKey

HPNWHOBVFZEFCZ-IMGBLTPTSA-N

Smiles

C[C@H](CCCc1ccccc1)/C=C/CCC(=O)O[C@@H]2[C@H]([C@]3(O[C@@H]([C@]([C@@]2(O3)C(=O)O)(C(=O)O)O)C(=O)O)CC/C=C/[C@H](C)CCCc4ccccc4)O