(3S,10S,13R,14R,17S)-17-[(E,2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-ol (Q15410963)

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

21 September 2016

chemical formula

C₃₀H₄₈O₂

1 reference

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

21 September 2016

canonical SMILES

CC(CCC=C(C)CO)C1CCC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)O)C)C)C

1 reference

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

21 September 2016

isomeric SMILES

C[C@H](CC/C=C(\C)/CO)[C@@H]1CC[C@@]2([C@@]1(CC=C3C2=CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C

1 reference

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

InChI=1S/C30H48O2/c1-20(19-31)9-8-10-21(2)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,11,14,21-22,25-26,31-32H,8,10,12-13,15-19H2,1-7H3/b20-9+/t21-,22+,25?,26+,28-,29-,30+/m1/s1

21 September 2016

Identifiers

InChI

1 reference

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

AOXXVRDKZLRGTJ-CUJMEZSJSA-N

21 September 2016

InChIKey

1 reference

(2S,5S,11R,14S,15R)-14-[(2R,5E)-7-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,11,15-PENTAMETHYLTETRACYCLO[8.7.0.0(2),?.0(1)(1),(1)?]HEPTADECA-1(17),9-DIEN-5-OL (English)

21 September 2016

1 reference

(3beta,5xi,17alpha,24E)-Lanosta-7,9(11),24-triene-3,26-diol (English)

21 September 2016

1 reference