Ergost-5-en-3-ol, 3-(4-hydroxyphenyl)-2-propenoate, (3β,24R)-
CAS Registry Number®
156297-95-9
CAS Name
Ergost-5-en-3-ol, 3-(4-hydroxyphenyl)-2-propenoate, (3β,24R)-Molecular Formula
C37H54O3Molecular Mass
546.82Cite this Page
Ergost-5-en-3-ol, 3-(4-hydroxyphenyl)-2-propenoate, (3β,24R)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=156297-95-9 (retrieved ) (CAS RN: 156297-95-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C37H54O3/c1-24(2)25(3)7-8-26(4)32-16-17-33-31-15-12-28-23-30(19-21-36(28,5)34(31)20-22-37(32,33)6)40-35(39)18-11-27-9-13-29(38)14-10-27/h9-14,18,24-26,30-34,38H,7-8,15-17,19-23H2,1-6H3/t25-,26-,30+,31+,32-,33+,34+,36+,37-/m1/s1
InChIKey
InChIKey=OOLXGDSPUCDFAL-MTTYNEBASA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(=CC3)C[C@@H](OC(C=CC5=CC=C(O)C=C5)=O)CC4)(CC1)[H])[H])(CC[C@@]2([C@@H](CC[C@H](C(C)C)C)C)[H])[H]
Canonical SMILES
O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(C)C(C)C)C2(C)CC1)C=CC5=CC=C(O)C=C5
Other Names for this Substance
- Ergost-5-en-3-ol, 3-(4-hydroxyphenyl)-2-propenoate, (3β,24R)-