Cercosporin

CAS Registry Number®

35082-49-6
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CAS Name

Cercosporin

Molecular Formula

C29H26O10

Molecular Mass

534.51

Cite this Page

Cercosporin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=35082-49-6 (retrieved 2024-04-24) (CAS RN: 35082-49-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    241 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C29H26O10/c1-10(30)5-12-18-19-13(6-11(2)31)29(37-4)27(35)21-15(33)8-17-23(25(19)21)22-16(38-9-39-17)7-14(32)20(24(18)22)26(34)28(12)36-3/h7-8,10-11,30-32,35H,5-6,9H2,1-4H3

InChIKey

InChIKey=JWFLIMIGORGZMQ-UHFFFAOYSA-N

SMILES

C(C(C)O)C=1C=2C=3C=4C5=C6C2C(CC(C)O)=C(OC)C(O)=C6C(=O)C=C5OCOC4C=C(O)C3C(=O)C1OC

Canonical SMILES

O=C1C=C2OCOC3=CC(O)=C4C(=O)C(OC)=C(C5=C4C3=C2C6=C1C(O)=C(OC)C(=C65)CC(O)C)CC(O)C

Other Names for this Substance

  • Perylo[1,12-def]-1,3-dioxepin-5,11-dione, 6,12-dihydroxy-8,9-bis[(2R)-2-hydroxypropyl]-7,10-dimethoxy-, (13bR)-
  • Cercosporin
  • Perylo[1,12-def]-1,3-dioxepin-5,11-dione, 6,12-dihydroxy-8,9-bis(2-hydroxypropyl)-7,10-dimethoxy-, stereoisomer
  • (13bR)-6,12-Dihydroxy-8,9-bis[(2R)-2-hydroxypropyl]-7,10-dimethoxyperylo[1,12-def]-1,3-dioxepin-5,11-dione
  • (+)-Cercosporin

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