CAS Registry Number®
82508-31-4
CAS Name
Pseudolaric acid B
Molecular Formula
C23H28O8
Molecular Mass
432.46
Compound Properties
-
Melting Point (1)
143-144 °C
Source(s)
- (1) Trost, Barry M.; Journal of the American Chemical Society, (2007), 129(47), 14556-14557, CAplus
Other Names and Identifiers
InChI
InChI=1S/C23H28O8/c1-14(18(25)26)6-5-10-21(3)17-9-12-22(20(28)31-21)11-7-16(19(27)29-4)8-13-23(17,22)30-15(2)24/h5-7,10,17H,8-9,11-13H2,1-4H3,(H,25,26)/b10-5+,14-6+/t17-,21+,22+,23-/m0/s1
InChIKey
InChIKey=VDGOFNMYZYBUDT-YDRCMHEVSA-N
SMILES
O(C(C)=O)[C@]12[C@]3(C(=O)O[C@@](/C=C/C=C(/C(O)=O)\C)(C)[C@@]1(CC3)[H])CC=C(C(OC)=O)CC2
Canonical SMILES
O=C(O)C(=CC=CC1(OC(=O)C23CC=C(C(=O)OC)CCC3(OC(=O)C)C1CC2)C)C
Other Names for this Substance
- 1H-4,9a-Ethanocyclohepta[c]pyran-7-carboxylic acid, 4a-(acetyloxy)-3-[(1E,3E)-4-carboxy-1,3-pentadien-1-yl]-3,4,4a,5,6,9-hexahydro-3-methyl-1-oxo-, 7-methyl ester, (3R,4S,4aS,9aR)-
- 1H-4,9a-Ethanocyclohepta[c]pyran-7-carboxylic acid, 4a-(acetyloxy)-3-(4-carboxy-1,3-pentadienyl)-3,4,4a,5,6,9-hexahydro-3-methyl-1-oxo-, 7-methyl ester, [3R-[3α(1E,3E),4α,4aα,9aα]]-
- 1H-4,9a-Ethanocyclohepta[c]pyran-7-carboxylic acid, 4a-(acetyloxy)-3-[(1E,3E)-4-carboxy-1,3-pentadienyl]-3,4,4a,5,6,9-hexahydro-3-methyl-1-oxo-, 7-methyl ester, (3R,4S,4aS,9aR)-
- Pseudolaric acid B
- NSC 615488
- Pseudolarix acid B
- (-)-Pseudolaric acid B
- O-Acetylpseudolaric acid C
