CAS Registry Number®
20362-31-6
CAS Name
Arctiin
Molecular Formula
C27H34O11
Molecular Mass
534.55
Compound Properties
-
Melting Point (1)
112 °C
Source(s)
- (1) Inagaki, Isao; Chemical & Pharmaceutical Bulletin, (1968), 16(11), 2307-8, CAplus
Other Names and Identifiers
InChI
InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3/t16-,17+,22+,23+,24-,25+,27+/m0/s1
InChIKey
InChIKey=XOJVHLIYNSOZOO-SWOBOCGESA-N
SMILES
C([C@@H]1[C@@H](CC2=CC(OC)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2)C(=O)OC1)C4=CC(OC)=C(OC)C=C4
Canonical SMILES
O=C1OCC(CC2=CC=C(OC)C(OC)=C2)C1CC3=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-, (3R,4R)-
- Arctiin
- 2(3H)-Furanone, 4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-, (3R–trans)-
- (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]-3-[[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-2(3H)-furanone
- Arctigenin-4-glucoside
- NSC 315527
- Arctii
- Arctin
Deleted or Replaced CAS Registry Numbers
27193-46-0
