U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C38H58O4
Molecular Weight 578.8647
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CAMPESTANYL FERULATE

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)\C=C\C5=CC(OC)=C(O)C=C5)[C@H](C)CC[C@@H](C)C(C)C

InChI

InChIKey=NLHPCZDTMWKEFC-GTKUFFLCSA-N
InChI=1S/C38H58O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-11,16-17,22,24-26,28-33,39H,8-9,12-15,18-21,23H2,1-7H3/b17-11+/t25-,26-,28+,29+,30+,31-,32+,33+,37+,38-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CAMPESTANYL FERULATE
Common Name English
CAMPESTANOL TRANS-FERULATE
Common Name English
ERGOSTAN-3-OL, 3-((2E)-3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOATE), (3.BETA.,5.ALPHA.,24R)-
Systematic Name English
TRANS-FERULOYLCAMPESTANOL
Common Name English
TRANS-CAMPESTANYL FERULATE
Common Name English
Code System Code Type Description
FDA UNII
GID12I848G
Created by admin on Sat Dec 16 08:45:54 GMT 2023 , Edited by admin on Sat Dec 16 08:45:54 GMT 2023
PRIMARY
PUBCHEM
13786591
Created by admin on Sat Dec 16 08:45:54 GMT 2023 , Edited by admin on Sat Dec 16 08:45:54 GMT 2023
PRIMARY
CAS
106774-77-0
Created by admin on Sat Dec 16 08:45:54 GMT 2023 , Edited by admin on Sat Dec 16 08:45:54 GMT 2023
PRIMARY
CAS
115587-23-0
Created by admin on Sat Dec 16 08:45:54 GMT 2023 , Edited by admin on Sat Dec 16 08:45:54 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY