Chemical Compound

Trichorabdal B

CAS Registry Number 79859-42-0
Trichorabdal B chemical structure
Primary Record

Trichorabdal B

In stock
8,116 g
Purity
98.7 %
CAS
79859-42-0

Compound Identifiers & Properties

CAS
79859-42-0
PubChem CID
13241290
SMILES
CC(=O)OC[C@@]1(CCC[C@@]2([C@@H]1C=O)COC(=O)[C@]34[C@H]2[C@@H](C[C@H](C3)C(=C)C4=O)O)C
Canonical SMILES
C=C1C(=O)[C@]23C[C@H]1C[C@@H](O)[C@H]2[C@@]1(CCC[C@@](C)(COC(C)=O)[C@H]1C=O)COC3=O

Names & Synonyms

  • Trichorabdal B
  • RefChem:1048818
  • BUJZGALXYNSLEB-YCYJFFQMSA-
  • NSC 639447
  • BRN 5778781
  • 79859-42-0
  • [(1S,1'R,2'R,5R,6S,7R,9S)-2'-Formyl-7-hydroxy-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate
  • ((1S,1'R,2'R,5R,6S,7R,9S)-2'-Formyl-7-hydroxy-1'-methyl-10-methylidene-2,11-dioxospiro(3-oxatricyclo(7.2.1.01,6)dodecane-5,3'-cyclohexane)-1'-yl)methyl acetate
  • InChI=1/C22H28O7/c1-12-14-7-15(25)17-21(11-29-19(27)22(17,8-14)18(12)26)6-4-5-20(3,16(21)9-23)10-28-13(2)24/h9,14-17,25H,1,4-8,10-11H2,2-3H3/t14-,15-,16-,17+,20+,21+,22+/m1/s1
  • Spiro(cyclohexane-1,4'(3'H)-(1H-7,9a)methanocyclohepta(c)pyran)-2-carboxaldehyde, 3-((acetyloxy)methyl)hexahydro-5'-hydroxy-3-methyl-8'-methylene-1',9'-dioxo-, (4'R-(4'-alpha(2R*,3R*),4'a-alpha,5'-beta,7'-beta,9'a-beta))-