CAS Registry Number®
51938-32-0
CAS Name
Schaftoside
Molecular Formula
C26H28O14
Molecular Mass
564.49
Compound Properties
-
Melting Point (1)
228 °C
Source(s)
- (1) Plouvier, Victor; Comptes Rendus des Seances de l’Academie des Sciences, Serie D: Sciences Naturelles, (1967), 265(6), 5116-19, CAplus
Other Names and Identifiers
InChI
InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)15-19(33)14-10(29)5-12(8-1-3-9(28)4-2-8)39-24(14)16(20(15)34)25-22(36)17(31)11(30)7-38-25/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22+,23+,25-,26-/m0/s1
InChIKey
InChIKey=MMDUKUSNQNWVET-VYUBKLCTSA-N
SMILES
OC=1C(=C2C(=C(O)C1[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C=C(O2)C4=CC=C(O)C=C4)[C@H]5[C@H](O)[C@@H](O)[C@@H](O)CO5
Canonical SMILES
O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OCC(O)C(O)C3O)C4OC(CO)C(O)C(O)C4O)C=5C=CC(O)=CC5
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 8-α-L-arabinopyranosyl-6-β-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-
- 8-α-L-Arabinopyranosyl-6-β-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
- Schaftoside
- 6-C-β-D-Glucosyl-8-C-α-L-arabinosylapigenin
- Apigenin 8-C-α-L-arabinoside 6-C-β-D-glucoside
- Shaftoside
- Apigenin 6-C-β-D-glucoside 8-C-α-L-arabinoside
- Apigenin (8-C-α-L-arabinosyl) 6-C-β-D-glucopyranoside
- Apigenin 6-C-glucoside-8-C-arabinoside
Deleted or Replaced CAS Registry Numbers
1367372-85-7, 1373344-46-7
