(3bS,5aS,7R,8R,10aR,10bR)-7-[(β-D-Glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-5a,8-methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one

CAS Registry Number®

42612-19-1

CAS Name

(3bS,5aS,7R,8R,10aR,10bR)-7-[(β-D-Glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-5a,8-methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one

Molecular Formula

C26H36O10

Molecular Mass

508.56

Cite this Page

(3bS,5aS,7R,8R,10aR,10bR)-7-[(β-D-Glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-5a,8-methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42612-19-1 (retrieved 2024-11-08) (CAS RN: 42612-19-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H36O10/c27-9-17-19(30)20(31)21(32)23(36-17)35-12-26(33)10-24-5-3-15-14-4-6-34-22(14)16(29)8-25(15,11-28)18(24)2-1-13(26)7-24/h4,6,13,15,17-21,23,27-28,30-33H,1-3,5,7-12H2/t13-,15-,17-,18-,19-,20+,21-,23-,24+,25+,26+/m1/s1

InChIKey

InChIKey=TXMUQQBIIGAMBQ-COYPLDDNSA-N

SMILES

C(O)[C@]12[C@]3([C@]4(C[C@]([C@](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)(O)C4)(CC3)[H])CC[C@@]1(C6=C(C(=O)C2)OC=C6)[H])[H]

Canonical SMILES

O=C1C=2OC=CC2C3CCC45CC(CCC4C3(CO)C1)C(O)(COC6OC(CO)C(O)C(O)C6O)C5

Other Names for this Substance

  • 5a,8-Methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one, 7-[(β-D-glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-, (3bS,5aS,7R,8R,10aR,10bR)-
  • 5a,8-Methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one, 7-[(β-D-glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-, [3bS-(3bα,5aβ,7β,8β,10aα,10bβ)]-
  • (3bS,5aS,7R,8R,10aR,10bR)-7-[(β-D-Glucopyranosyloxy)methyl]-4,5,6,7,8,9,10,10a,10b,11-decahydro-7-hydroxy-10b-(hydroxymethyl)-5a,8-methano-5aH-cyclohepta[5,6]naphtho[2,1-b]furan-12(3bH)-one
  • Cafamarin

CAS INSIGHTSTM
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