Verrucarin J

CAS Registry Number®

4643-58-7
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CAS Name

Verrucarin J

Molecular Formula

C27H32O8

Molecular Mass

484.54

Cite this Page

Verrucarin J.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4643-58-7 (retrieved 2024-05-18) (CAS RN: 4643-58-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H32O8/c1-17-8-10-26-15-32-24(30)13-18(2)9-11-31-22(28)6-4-5-7-23(29)35-19-14-21(34-20(26)12-17)27(16-33-27)25(19,26)3/h4-7,12-13,19-21H,8-11,14-16H2,1-3H3/b6-4+,7-5+,18-13+/t19-,20-,21-,25-,26-,27+/m1/s1

InChIKey

InChIKey=GXCGYHWSYNQVHU-UGAPSZEOSA-N

SMILES

C[C@]12[C@@]3([C@@]4(O[C@]5([C@@]1(CCC(C)=C5)COC(=O)/C=C(\C)/CCOC(=O)\C=C\C=C\C(=O)O[C@@]2(C4)[H])[H])[H])CO3

Canonical SMILES

O=C1OCCC(=CC(=O)OCC23CCC(=CC3OC4CC(OC(=O)C=CC=C1)C2(C)C54OC5)C)C

Other Names for this Substance

  • Verrucarin A, 2′,3′-didehydro-2′-deoxy-, (2′E)-
  • Verrucarin J
  • Spiro[16,18-methano-1H,3H,23H-[1,6,12]trioxacyclooctadecino[3,4-d][1]benzopyran-17(18H),2′-oxirane], verrucarin A deriv.
  • (2′E)-2′,3′-Didehydro-2′-deoxyverrucarin A
  • Muconomycin B

Deleted or Replaced CAS Registry Numbers

18046-06-5, 25327-51-9

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