2D Structure | |
CID | 71770218 |
Target | / |
IUPAC Name | (1R,4R,4aR,7aS,7bR)-3-(hydroxymethyl)-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]indene-1,4-diol |
InChI | InChI=1S/C15H24O3/c1-14(2)5-8-11(6-14)15(3)10(4-12(15)17)9(7-16)13(8)18/h8,11-13,16-18H,4-7H2,1-3H3/t8-,11+,12-,13-,15+/m1/s1 |
InChI Key | UJMSEIFAJPZTAL-MPAKNLCJSA-N |
Canonical SMILES | CC1(CC2C(C1)C3(C(CC3=C(C2O)CO)O)C)C |
Isomeric SMILES | C[C@]12[C@@H](CC1=C([C@@H]([C@H]3[C@@H]2CC(C3)(C)C)O)CO)O |
Molecular Formula | C15H24O3 |
Molecular Weight | 252.35 |
synonyms | ['Illudol', 'G0RQ2R967C', 'UNII-G0RQ2R967C', '16981-75-2', '(1R,4R,4aR,7aS,7bR)-2,4,4a,5,6,7,7a,7b-Octahydro-3-(hydroxymethyl)-6,6,7b-trimethyl-1H-cyclobut(E)indene-1,4-diol', '1H-Cyclobut(E)indene-1,4-diol, 2,4,4a,5,6,7,7a,7b-octahydro-3-(hydroxymethyl)-6,6,7b-trimethyl-, (1R,4R,4aR,7aS,7bR)-', '1H-CYCLOBUT(E)INDENE-1,4-DIOL, 2,4,4A,5,6,7,7A,7B-OCTAHYDRO-3-(HYDROXYMETHYL)-6,6,7B-TRIMETHYL-, (1R-(1.ALPHA.,4.ALPHA.,4A.BETA.,7A.BETA.,7B.ALPHA.))-', '1H-Cyclobut(E)indene-1,4-diol, 2,4,4a,5,6,7,7a,7b-octahydro-3-(hydroxymethyl)-6,6,7b-trimethyl-, (1R-(1alpha,4alpha,4abeta,7abeta,7balpha))-', '(1R,4R,4aR,7aS,7bR)-3-(hydroxymethyl)-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta(e)indene-1,4-diol', '(1R,4R,4aR,7aS,7bR)-3-(hydroxymethyl)-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]indene-1,4-diol', 'sxkcpxhmcbvtnq-uhfffaoysa-n', 'Q27278493'] |
From Pubchem