Stigmasteryl palmitate

CAS Registry Number®

2308-84-1

CAS Name

Stigmasteryl palmitate

Molecular Formula

C45H78O2

Molecular Mass

651.10

Cite this Page

Stigmasteryl palmitate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2308-84-1 (retrieved 2024-11-23) (CAS RN: 2308-84-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    99.5 °C

Source(s)

Other Names and Identifiers

InChI

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/h23-25,34-36,38-42H,8-22,26-33H2,1-7H3/b24-23+/t35-,36-,38+,39+,40-,41+,42+,44+,45-/m1/s1

InChIKey

InChIKey=OHLDETMXEXJUDZ-SYYHSBNDSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](/C=C/[C@H](C(C)C)CC)C)(CC4)[H])[H])(CC=C1C[C@@H](OC(CCCCCCCCCCCCCCC)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C=CC(CC)C(C)C)C)C2(C)CC1)CCCCCCCCCCCCCCC

Other Names for this Substance

  • Stigmasta-5,22-dien-3-ol, 3-hexadecanoate, (3β,22E)-
  • Stigmasta-5,22-dien-3β-ol, palmitate
  • Stigmasta-5,22-dien-3-ol, hexadecanoate, (3β,22E)-
  • Stigmasterol, palmitate
  • Palmitic acid, stigmasta-5,22-dien-3β-yl ester

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