Morellinol

CAS Registry Number®

55452-65-8
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CAS Name

Morellinol

Molecular Formula

C33H38O7

Molecular Mass

546.65

Cite this Page

Morellinol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55452-65-8 (retrieved 2024-09-20) (CAS RN: 55452-65-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H38O7/c1-17(2)8-9-21-27-20(11-12-30(4,5)38-27)25(35)24-26(36)22-14-19-15-23-31(6,7)40-32(29(19)37,13-10-18(3)16-34)33(22,23)39-28(21)24/h8,10-12,14,19,23,34-35H,9,13,15-16H2,1-7H3/b18-10-/t19?,23-,32-,33+/m0/s1

InChIKey

InChIKey=UWZMGTSPGQXAAP-MNVXDNCLSA-N

SMILES

C(/C=C(\CO)/C)[C@@]12[C@]34C(C(=O)C=5C(O3)=C(CC=C(C)C)C6=C(C5O)C=CC(C)(C)O6)=CC(C1=O)(C[C@]4(C(C)(C)O2)[H])[H]

Canonical SMILES

O=C1C2=C(O)C=3C=CC(OC3C(=C2OC45C1=CC6C(=O)C5(OC(C)(C)C4C6)CC=C(C)CO)CC=C(C)C)(C)C

Other Names for this Substance

  • 1,5-Methano-1H,7H,11H-furo[3,4-g]pyrano[3,2-b]xanthene-7,15-dione, 3,3a,4,5-tetrahydro-8-hydroxy-1-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-3,3,11,11-tetramethyl-13-(3-methyl-2-buten-1-yl)-, (1R,3aS,5S,14aS)-
  • 1,5-Methano-1H,7H,11H-furo[3,4-g]pyrano[3,2-b]xanthene-7,15-dione, 3,3a,4,5-tetrahydro-8-hydroxy-1-(4-hydroxy-3-methyl-2-butenyl)-3,3,11,11-tetramethyl-13-(3-methyl-2-butenyl)-, [1R-[1α,1(Z),3aβ,5α,14aS*]]-
  • 1,5-Methano-1H,7H,11H-furo[3,4-g]pyrano[3,2-b]xanthene-7,15-dione, 3,3a,4,5-tetrahydro-8-hydroxy-1-[(2Z)-4-hydroxy-3-methyl-2-butenyl]-3,3,11,11-tetramethyl-13-(3-methyl-2-butenyl)-, (1R,3aS,5S,14aS)-
  • (1R,3aS,5S,14aS)-3,3a,4,5-Tetrahydro-8-hydroxy-1-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-3,3,11,11-tetramethyl-13-(3-methyl-2-buten-1-yl)-1,5-methano-1H,7H,11H-furo[3,4-g]pyrano[3,2-b]xanthene-7,15-dione
  • Morellinol