Erteberel | |
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Molecular structure via molpic based on CDK |
Conformer [] | |
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Conformer structure via JSmol |
Physical properties [] | |
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Molecular mass | 282.3 g/mol [1] |
Predicted LogP | 4 [1] |
Structural Identifiers [] | |
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Molecular formula | C18H18O3 [1] |
IUPAC name | (3aS,4R,9bR)-4-(4-hydroxyphenyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen-8-ol [1] |
SMILES | C1C[C@H]2[C@@H](C1)C3=C(C=CC(=C3)O)O[C@H]2C4=CC=C(C=C4)O [1] |
InChI | InChI=1S/C18H18O3/c19-12-6-4-11(5-7-12)18-15-3-1-2-14(15)16-10-13(20)8-9-17(16)21-18/h4-10,14-15,18-20H,1-3H2/t14-,15+,18+/m1/s1 [1] |
InChIKey | XIESSJVMWNJCGZ-VKJFTORMSA-N [1] |
Erteberel
Erteberel (also known as LY500307, SERBA-1, LY-500307, LY 500307, (3aS,4R,9bR)-4-(4-Hydroxyphenyl)-1,2,3,3a,4,9b-hexahydrocyclopenta(c)(1) benzopyran-8-ol, Cyclopenta(c)(1)benzopyran-8-ol, 1,2,3,3a,4,9b-hexahydro-4-(4-hydroxyphenyl)-, (3aS,4R,9bR)-, (3As,4r,9br)-4-(4-hydroxyphenyl)-1,2,3,3a,4,9b-hexahydrocyclopenta(c)(1)benzopyran-8-ol, erteberelum, (2R,6S,7R)-7-(4-hydroxyphenyl)-8-oxatricyclo(7.4.0.02,?)trideca-1(9),10,12-trien-12-ol or (2R,6S,7R)-7-(4-hydroxyphenyl)-8-oxatricyclo[7.4.0.02,?]trideca-1(9),10,12-trien-12-ol)
Chemistry
Stereochemistry []
Erteberel is a absolute mixture