α-Amyrin palmitate
CAS Registry Number®
22255-10-3
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CAS Name
α-Amyrin palmitateMolecular Formula
C46H80O2Molecular Mass
665.13Cite this Page
α-Amyrin palmitate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=22255-10-3 (retrieved ) (CAS RN: 22255-10-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-40(47)48-39-28-30-44(7)37(42(39,4)5)27-31-46(9)38(44)25-24-36-41-35(3)34(2)26-29-43(41,6)32-33-45(36,46)8/h24,34-35,37-39,41H,10-23,25-33H2,1-9H3/t34-,35+,37+,38-,39+,41+,43-,44+,45-,46-/m1/s1
InChIKey
InChIKey=BHPGRVQWTLDDQX-IBZMRETLSA-N
SMILES
C[C@]12[C@@]3(C)C([C@]4([C@@](C)(CC3)CC[C@@H](C)[C@@H]4C)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](OC(CCCCCCCCCCCCCCC)=O)CC5)[H])[H]
Canonical SMILES
O=C(OC1CCC2(C)C3CC=C4C5C(C)C(C)CCC5(C)CCC4(C)C3(C)CCC2C1(C)C)CCCCCCCCCCCCCCC
Other Names for this Substance
- Urs-12-en-3-ol, 3-hexadecanoate, (3β)-
- Urs-12-en-3β-ol, palmitate
- Urs-12-en-3-ol, hexadecanoate, (3β)-
- α-Amyrin palmitate
- 3β-Palmitoyl-α-amyrin
Deleted or Replaced CAS Registry Numbers
290299-11-5
