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Substance Name: 4-Benzylactone
RN: 27675-77-0
InChIKey: NHMODCAASJDQKF-TYILLQQXSA-N

Note

  • From Torreya jackii.

Molecular Formula

  • C20-H18-O7

Molecular Weight

  • 370.355
 
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Names and Synonyms

Name of Substance

  • 4-Benzylactone

Synonym

  • para-Benzlactone

Systematic Name

  • 2(3H)-Furanone, 4-(1,3-benzodioxol-5-ylhydroxymethyl)-3-(1,3-benzodioxol-5-ylmethyl)dihydro-, (3R-(3alpha,4beta(R*)))-

Registry Numbers

CAS Registry Number

  • 27675-77-0

System Generated Number

  • 0027675770

Structure Descriptors

InChI

1S/C20H18O7/c21-19(12-2-4-16-18(7-12)27-10-25-16)14-8-23-20(22)13(14)5-11-1-3-15-17(6-11)26-9-24-15/h1-4,6-7,13-14,19,21H,5,8-10H2/t13-,14+,19+/m1/s1

InChIKey

NHMODCAASJDQKF-TYILLQQXSA-N

Smiles

O1C([C@@H]([C@H](C1)[C@@H](O)c1cc2OCOc2cc1)Cc1cc2OCOc2cc1)=O