Cleistanthin B

CAS Registry Number®

30021-77-3
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CAS Name

Cleistanthin B

Molecular Formula

C27H26O12

Molecular Mass

542.49

Cite this Page

Cleistanthin B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=30021-77-3 (retrieved 2024-07-26) (CAS RN: 30021-77-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H26O12/c1-33-16-6-12-13(7-17(16)34-2)25(39-27-24(31)23(30)22(29)19(8-28)38-27)14-9-35-26(32)21(14)20(12)11-3-4-15-18(5-11)37-10-36-15/h3-7,19,22-24,27-31H,8-10H2,1-2H3/t19-,22-,23+,24-,27+/m1/s1

InChIKey

InChIKey=BJGIWVGXMRUMNA-WBYCZGBQSA-N

SMILES

O=C1C2=C(C=3C(C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C2CO1)=CC(OC)=C(OC)C3)C=5C=C6C(=CC5)OCO6

Canonical SMILES

O=C1OCC=2C(OC3OC(CO)C(O)C(O)C3O)=C4C=C(OC)C(OC)=CC4=C(C=5C=CC=6OCOC6C5)C12

Other Names for this Substance

  • Naphtho[2,3-c]furan-1(3H)-one, 9-(1,3-benzodioxol-5-yl)-4-(β-D-glucopyranosyloxy)-6,7-dimethoxy-
  • Cleistanthin B
  • 9-(1,3-Benzodioxol-5-yl)-4-(β-D-glucopyranosyloxy)-6,7-dimethoxynaphtho[2,3-c]furan-1(3H)-one
  • Diphyllin β-D-glucopyranoside
  • Diphyllin O-glucoside

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Deleted or Replaced CAS Registry Numbers

132278-22-9, 30928-09-7