(3β,5β,12β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5,12,14-trihydroxycard-20(22)-enolide

CAS Registry Number®

3981-16-6
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CAS Name

(3β,5β,12β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5,12,14-trihydroxycard-20(22)-enolide

Molecular Formula

C29H44O10

Molecular Mass

552.65

Cite this Page

(3β,5β,12β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5,12,14-trihydroxycard-20(22)-enolide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3981-16-6 (retrieved 2024-09-19) (CAS RN: 3981-16-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    192-200 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C29H44O10/c1-14-22(32)23(33)24(34)25(38-14)39-16-4-7-26(2)19-11-20(30)27(3)17(15-10-21(31)37-13-15)6-9-29(27,36)18(19)5-8-28(26,35)12-16/h10,14,16-20,22-25,30,32-36H,4-9,11-13H2,1-3H3/t14-,16-,17+,18+,19-,20+,22-,23+,24+,25-,26+,27-,28-,29-/m0/s1

InChIKey

InChIKey=VRDSLDHRGHMDAC-KDCJLTIJSA-N

SMILES

O[C@@]12[C@@](C)([C@H](CC1)C=3COC(=O)C3)[C@H](O)C[C@]4([C@]2(CC[C@@]5(O)[C@]4(C)CC[C@H](O[C@H]6[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O6)C5)[H])[H]

Canonical SMILES

O=C1OCC(=C1)C2CCC3(O)C4CCC5(O)CC(OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CC(O)C23C

Other Names for this Substance

  • Card-20(22)-enolide, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-5,12,14-trihydroxy-, (3β,5β,12β)-
  • Antioside
  • (3β,5β,12β)-3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5,12,14-trihydroxycard-20(22)-enolide
  • α-Antioside
  • α-Antiosid

Deleted or Replaced CAS Registry Numbers

53682-13-6, 59170-21-7