Cyclamine

CAS Registry Number®

23643-76-7

CAS Name

Cyclamine

Molecular Formula

C58H94O27

Molecular Mass

1223.35

Cite this Page

Cyclamine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23643-76-7 (retrieved 2024-11-22) (CAS RN: 23643-76-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    253-254 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C58H94O27/c1-52(2)29-7-11-55(5)30(8-12-58-31-15-53(3,22-62)13-14-57(31,23-77-58)32(64)16-56(55,58)6)54(29,4)10-9-33(52)82-50-45(84-49-43(74)40(71)36(67)26(18-60)79-49)38(69)28(21-76-50)81-51-46(85-47-41(72)34(65)24(63)20-75-47)44(37(68)27(19-61)80-51)83-48-42(73)39(70)35(66)25(17-59)78-48/h22,24-51,59-61,63-74H,7-21,23H2,1-6H3/t24-,25-,26-,27-,28+,29+,30-,31?,32-,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,44+,45-,46-,47+,48+,49+,50+,51+,53+,54+,55-,56+,57-,58+/m1/s1

InChIKey

InChIKey=JPEQATLMKATGAQ-HORBOQECSA-N

SMILES

C[C@]12[C@@]3(C4([C@@](CO3)([C@H](O)C1)CC[C@@](C=O)(C)C4)[H])CC[C@]5([C@@]2(C)CC[C@@]6([C@]5(C)CC[C@H](O[C@H]7[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@@H](O[C@H]9[C@H](O[C@H]%10[C@H](O)[C@@H](O)[C@H](O)CO%10)[C@@H](O[C@@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)[C@H](O)[C@@H](CO)O9)CO7)C6(C)C)[H])[H]

Canonical SMILES

O=CC1(C)CCC23COC4(CCC5C6(C)CCC(OC7OCC(OC8OC(CO)C(O)C(OC9OC(CO)C(O)C(O)C9O)C8OC%10OCC(O)C(O)C%10O)C(O)C7OC%11OC(CO)C(O)C(O)C%11O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1

Other Names for this Substance

  • Oleanan-29-al, 13,28-epoxy-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→2)]-O-β-D-glucopyranosyl-(1→4)-O-[β-D-glucopyranosyl-(1→2)]-α-L-arabinopyranosyl)oxy]-16-hydroxy-, (3β,16α,20β)-
  • Cyclamin (saponin)
  • Cyclamine
  • 2H,5H-14a,4a-(Epoxymethano)picene, oleanan-29-al deriv.
  • (3β,16α,20β)-13,28-Epoxy-3-[(O-β-D-glucopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→2)]-O-β-D-glucopyranosyl-(1→4)-O-[β-D-glucopyranosyl-(1→2)]-α-L-arabinopyranosyl)oxy]-16-hydroxyoleanan-29-al

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Deleted or Replaced CAS Registry Numbers

32057-16-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration