rel-(-)-(4R,6S,6aR,7S,12R,12aS)-3,4,6,6a,7,12-Hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-4,12a-methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one

CAS Registry Number®

225110-59-8
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CAS Name

rel-(-)-(4R,6S,6aR,7S,12R,12aS)-3,4,6,6a,7,12-Hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-4,12a-methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one

Molecular Formula

C16H18O7

Molecular Mass

322.31

Cite this Page

rel-(-)-(4R,6S,6aR,7S,12R,12aS)-3,4,6,6a,7,12-Hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-4,12a-methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=225110-59-8 (retrieved 2024-06-25) (CAS RN: 225110-59-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H18O7/c1-7-16(21)14(20)12-9(3-2-4-10(12)17)13(19)15(16)6-8(22-7)5-11(18)23-15/h2-4,7-8,13-14,17,19-21H,5-6H2,1H3/t7-,8-,13+,14-,15-,16-/m0/s1

InChIKey

InChIKey=YAYLZJMYAWCSFK-MAHXAKIKSA-N

SMILES

O[C@]12[C@@]3([C@H](O)C=4C([C@@H]1O)=C(O)C=CC4)C[C@@](O[C@H]2C)(CC(=O)O3)[H]

Canonical SMILES

O=C1OC23CC(OC(C)C3(O)C(O)C=4C(O)=CC=CC4C2O)C1

Other Names for this Substance

  • 4,12a-Methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one, 3,4,6,6a,7,12-hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-, (4R,6S,6aR,7S,12R,12aS)-rel-(-)-
  • 4,12a-Methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one, 3,4,6,6a,7,12-hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-, (4R,6S,6aR,7S,12R,12aS)-rel-
  • rel-(-)-(4R,6S,6aR,7S,12R,12aS)-3,4,6,6a,7,12-Hexahydro-6a,7,8,12-tetrahydroxy-6-methyl-4,12a-methano-2H,12aH-naphtho[2,3-b]-1,5-dioxocin-2-one
  • Luisol A

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