CAS Registry Number®
33464-71-0
CAS Name
Tracheloside
Molecular Formula
C27H34O12
Molecular Mass
550.55
Compound Properties
-
Melting Point (1)
176 °C (decomp)
Source(s)
- (1) Miyazaki, Michiharu; Yakugaku Zasshi, (1958), 78, 879-82, CAplus
Other Names and Identifiers
InChI
InChI=1S/C27H34O12/c1-34-17-6-4-14(9-19(17)35-2)8-16-13-37-26(32)27(16,33)11-15-5-7-18(20(10-15)36-3)38-25-24(31)23(30)22(29)21(12-28)39-25/h4-7,9-10,16,21-25,28-31,33H,8,11-13H2,1-3H3/t16-,21+,22+,23-,24+,25+,27-/m0/s1
InChIKey
InChIKey=LWYAMIUSVGPFKS-CGLYQLBNSA-N
SMILES
C([C@@H]1[C@](CC2=CC(OC)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2)(O)C(=O)OC1)C4=CC(OC)=C(OC)C=C4
Canonical SMILES
O=C1OCC(CC2=CC=C(OC)C(OC)=C2)C1(O)CC3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(OC)=C3
Other Names for this Substance
- 2(3H)-Furanone, 4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-3-hydroxy-, (3S,4S)-
- 2(3H)-Furanone, 4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-3-hydroxy-, (3S–cis)-
- Tracheloside
- (3S,4S)-4-[(3,4-Dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-3-hydroxy-2(3H)-furanone
- 2-Hydroxyarctiin
- 8′-Hydroxyarctigenin-4′-O-β-D-glucoside
Deleted or Replaced CAS Registry Numbers
27775-03-7, 32810-37-0, 38659-14-2
