Isogarcinol
CAS Registry Number®
71117-97-0
No image available.
CAS Name
IsogarcinolMolecular Formula
C38H50O6Molecular Mass
602.80Cite this Page
Isogarcinol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=71117-97-0 (retrieved ) (CAS RN: 71117-97-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
251 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C38H50O6/c1-22(2)11-14-26-20-37-21-27(15-12-23(3)4)36(9,10)44-33(37)30(31(41)25-13-16-28(39)29(40)19-25)32(42)38(34(37)43,35(26,7)8)18-17-24(5)6/h11-13,16-17,19,26-27,39-40H,14-15,18,20-21H2,1-10H3/t26-,27+,37+,38+/m1/s1
InChIKey
InChIKey=KXTNVBQRLRYVCO-LPSZMIQCSA-N
SMILES
O=C1[C@@]23C(=C(C(=O)C4=CC(O)=C(O)C=C4)C(=O)[C@]1(CC=C(C)C)C(C)(C)[C@H](CC=C(C)C)C2)OC(C)(C)[C@@H](CC=C(C)C)C3
Canonical SMILES
O=C(C1=CC=C(O)C(O)=C1)C=2C(=O)C3(C(=O)C4(C2OC(C)(C)C(CC=C(C)C)C4)CC(CC=C(C)C)C3(C)C)CC=C(C)C
Other Names for this Substance
- 9H-4a,8-Methano-2H-cycloocta[b]pyran-9,11-dione, 10-(3,4-dihydroxybenzoyl)-3,4,5,6,7,8-hexahydro-2,2,7,7-tetramethyl-3,6,8-tris(3-methyl-2-buten-1-yl)-, (3S,4aS,6R,8R)-
- 9H-4a,8-Methano-2H-cycloocta[b]pyran-9,11-dione, 10-(3,4-dihydroxybenzoyl)-3,4,5,6,7,8-hexahydro-2,2,7,7-tetramethyl-3,6,8-tris(3-methyl-2-butenyl)-, [3S-(3α,4aβ,6α,8β)]-
- 9H-4a,8-Methano-2H-cycloocta[b]pyran-9,11-dione, 10-(3,4-dihydroxybenzoyl)-3,4,5,6,7,8-hexahydro-2,2,7,7-tetramethyl-3,6,8-tris(3-methyl-2-butenyl)-, (3S,4aS,6R,8R)-
- (3S,4aS,6R,8R)-10-(3,4-Dihydroxybenzoyl)-3,4,5,6,7,8-hexahydro-2,2,7,7-tetramethyl-3,6,8-tris(3-methyl-2-buten-1-yl)-9H-4a,8-methano-2H-cycloocta[b]pyran-9,11-dione
- Cambogin
Deleted or Replaced CAS Registry Numbers
78808-83-0