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Substance Name: Metachromin C
RN: 124596-50-5
InChIKey: RDBDWSGJCBFVNX-ABZGJHIISA-N

Note

  • From marine sponge Hippospongia metachroma.

Molecular Weight

  • 358.475
 
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Names and Synonyms

Name of Substance

  • Metachromin C

Systematic Name

  • 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(3-methyl-5-(1,2,3-trimethyl-3-cyclohexen-1-yl)-2-pentenyl)-, (1R-(1alpha(E),2alpha))-

Registry Numbers

CAS Registry Number

  • 124596-50-5

System Generated Number

  • 0124596505

Structure Descriptors

InChI

1S/C22H30O4/c1-14(10-12-22(4)11-6-7-15(2)16(22)3)8-9-17-20(24)18(23)13-19(26-5)21(17)25/h7-8,13,16,24H,6,9-12H2,1-5H3/b14-8+/t16-,22-/m1/s1

InChIKey

RDBDWSGJCBFVNX-ABZGJHIISA-N

Smiles

C[C@@H]1C(=CCC[C@]1(C)CC/C(=C/CC2=C(C(=O)C=C(C2=O)OC)O)/C)C