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Substance Name: Trichorabdal H
RN: 20086-59-3
InChIKey: ORDKVFHKMGUXSQ-TURJNOCPSA-N

Note

  • Isolated from the leaves of Rabdosia trichocarpa.

Molecular Formula

  • C22-H28-O7

Molecular Weight

  • 404.4562
 
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Names and Synonyms

Name of Substance

  • Trichorabdal H

Synonym

  • (4'S-(4'alpha(2S*,6R*),4'abeta,5'alpha,7'alpha,9'aalpha))-6-(Acetyloxy)hexahydro-5'-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxospiro(cyclohexane-1,4'(3'H)-(1H-7,9a)methanocyclohepta(c)pyran)-2-carboxaldehyde

Systematic Name

  • Spiro(cyclohexane-1,4'(3'H)-(1H-7,9a)methanocyclohepta(c)pyran)-2-carboxaldehyde, 6-(acetyloxy)hexahydro-5'-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxo-, (4'S-(4'alpha(2S*,6R*),4'abeta,5'alpha,7'alpha,9'aalpha))-

Registry Numbers

CAS Registry Number

  • 20086-59-3

System Generated Number

  • 0020086593

Structure Descriptors

InChI

1S/C22H28O7/c1-11-13-7-14(25)17-21(8-13,18(11)26)19(27)28-10-22(17)15(9-23)20(3,4)6-5-16(22)29-12(2)24/h9,13-17,25H,1,5-8,10H2,2-4H3/t13-,14-,15-,16+,17-,21+,22+/m1/s1

InChIKey

ORDKVFHKMGUXSQ-TURJNOCPSA-N

Smiles

CC(=O)O[C@H]1CCC(C)(C)[C@@H](C=O)[C@@]12COC(=O)[C@@]34C[C@@H](C[C@@H](O)[C@@H]23)C(=C)C4=O