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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H80O2
Molecular Weight 653.1155
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-SITOSTERYL PALMITATE

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)CCCCCCCCCCCCCCC)[C@H](C)CC[C@@H](CC)C(C)C

InChI

InChIKey=IWTJDVBNIUPPPB-FPNUYMRSSA-N
InChI=1S/C45H80O2/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-43(46)47-38-29-31-44(6)37(33-38)25-26-39-41-28-27-40(45(41,7)32-30-42(39)44)35(5)23-24-36(9-2)34(3)4/h25,34-36,38-42H,8-24,26-33H2,1-7H3/t35-,36-,38+,39+,40-,41+,42+,44+,45-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-SITOSTERYL PALMITATE
Common Name English
SITOSTEROL PALMITATE
Common Name English
.BETA.-ROSASTEROL PALMITATE
Common Name English
STIGMAST-5-EN-3-OL, 3-HEXADECANOATE, (3.BETA.)-
Systematic Name English
SITOSTERYL PALMITATE, (+)-
Common Name English
STIGMAST-5-EN-3.BETA.-OL, PALMITATE
Systematic Name English
Code System Code Type Description
PUBCHEM
9852570
Created by admin on Sat Dec 16 11:47:46 GMT 2023 , Edited by admin on Sat Dec 16 11:47:46 GMT 2023
PRIMARY
FDA UNII
LEB596GYDL
Created by admin on Sat Dec 16 11:47:46 GMT 2023 , Edited by admin on Sat Dec 16 11:47:46 GMT 2023
PRIMARY
CAS
2308-85-2
Created by admin on Sat Dec 16 11:47:46 GMT 2023 , Edited by admin on Sat Dec 16 11:47:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID601315058
Created by admin on Sat Dec 16 11:47:46 GMT 2023 , Edited by admin on Sat Dec 16 11:47:46 GMT 2023
PRIMARY