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Substance Name: beta-Sitosteryl palmitoleate
RN: 127271-10-7
UNII: GQU1KBY22Y
InChIKey: CHMZRMNZCBYIEO-WTQKZKLLSA-N

Molecular Formula

  • C45-H78-O2

Molecular Weight

  • 651.1092
 
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Names and Synonyms

Name of Substance

  • beta-Sitosteryl palmitoleate

Synonyms

  • beta-Sitosteryl palmitoleate
  • Stigmast-5-en-3-ol, 3-(9Z)-9-hexadecenoate, (3beta)-
  • UNII-GQU1KBY22Y

Registry Numbers

CAS Registry Number

  • 127271-10-7

FDA UNII

  • GQU1KBY22Y

System Generated Number

  • 0127271107

Structure Descriptors

InChI

1S/C45H78O2/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/h14-15,25,34-36,38-42H,8-13,16-24,26-33H2,1-7H3/b15-14-/t35-,36-,38+,39+,40-,41+,42+,44+,45-/m1/s1

InChIKey

CHMZRMNZCBYIEO-WTQKZKLLSA-N

Smiles

CCCCCC\C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CC[C@@H](CC)C(C)C