(-)-Cangorinine E-I

CAS Registry Number®

155944-24-4

CAS Name

(-)-Cangorinine E-I

Molecular Formula

C43H49NO18

Molecular Mass

867.85

Cite this Page

(-)-Cangorinine E-I.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=155944-24-4 (retrieved 2024-11-23) (CAS RN: 155944-24-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C43H49NO18/c1-20-21(2)37(50)61-34-32(57-24(5)47)36(59-26(7)49)42(19-54-22(3)45)35(58-25(6)48)31(56-23(4)46)29-33(60-38(51)27-14-11-10-12-15-27)43(42,41(34,9)53)62-40(29,8)18-55-39(52)28-16-13-17-44-30(20)28/h10-17,20-21,29,31-36,53H,18-19H2,1-9H3/t20-,21-,29+,31+,32-,33+,34-,35+,36-,40-,41-,42+,43-/m0/s1

InChIKey

InChIKey=DPTIBNOQWFLHCG-UAYAMSOCSA-N

SMILES

C(OC(C)=O)[C@]12[C@@]34[C@H](OC(=O)C5=CC=CC=C5)[C@]([C@@](C)(O3)COC(=O)C=6C([C@@H](C)[C@H](C)C(=O)O[C@]([C@]4(C)O)([C@H](OC(C)=O)[C@@H]1OC(C)=O)[H])=NC=CC6)([C@@H](OC(C)=O)[C@H]2OC(C)=O)[H]

Canonical SMILES

O=C1OCC2(OC34C(OC(=O)C=5C=CC=CC5)C2C(OC(=O)C)C(OC(=O)C)C4(COC(=O)C)C(OC(=O)C)C(OC(=O)C)C(OC(=O)C(C)C(C6=NC=CC=C16)C)C3(O)C)C

Other Names for this Substance

  • 8,11-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[4,3-b]pyridine-5,17-dione, 13,14,21,22-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-10-(benzoyloxy)-7,8,9,10,12,13,14,15,18,19-decahydro-20-hydroxy-8,18,19,20-tetramethyl-, (8R,9R,10R,11S,12R,13R,14R,15S,18S,19S,20S,21S,22R)-
  • Evonine, 8-(acetyloxy)-O6-benzoyl-O6-deacetyl-8-deoxo-, (8α)-
  • (8R,9R,10R,11S,12R,13R,14R,15S,18S,19S,20S,21S,22R)-13,14,21,22-Tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-10-(benzoyloxy)-7,8,9,10,12,13,14,15,18,19-decahydro-20-hydroxy-8,18,19,20-tetramethyl-8,11-epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[4,3-b]pyridine-5,17-dione
  • Cangorinine E-I
  • (-)-Cangorinine E-I

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