![Verbenalin[马鞭草苷]](https://newcny.com/wp-content/uploads/2024/06/548-37-8.svg)
CAS Registry Number®
548-37-8
CAS Name
Verbenalin
Molecular Formula
C17H24O10
Molecular Mass
388.37
Compound Properties
-
Melting Point (1)
183 °C
Source(s)
- (1) Bures, E.; Casopis Ceskoslovenskeho Lekarnictva, (1938), 18, 65-9, CAplus
Other Names and Identifiers
InChI
InChI=1S/C17H24O10/c1-6-3-8(19)11-7(15(23)24-2)5-25-16(10(6)11)27-17-14(22)13(21)12(20)9(4-18)26-17/h5-6,9-14,16-18,20-22H,3-4H2,1-2H3/t6-,9+,10+,11-,12+,13-,14+,16-,17-/m0/s1
InChIKey
InChIKey=HLXRWTJXGMHOFN-XJSNKYLASA-N
SMILES
O([C@H]1[C@]2([C@@](C(C(OC)=O)=CO1)(C(=O)C[C@@H]2C)[H])[H])[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(=O)CC3C
Other Names for this Substance
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, (1S,4aS,7S,7aR)-
- Verbenalin
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, [1S-(1α,4aα,7α,7aα)]-
- Verbenaloside
- Cornin (glycoside)
- Cornin
- NSC 118055
- 5-Deoxyhastatoside
Deleted or Replaced CAS Registry Numbers
1391-15-7
