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Substance Name: Amyrin palmitate
RN: 5973-06-8
InChIKey: VFSRKCNYYCXRGI-LAZBMHKSSA-N

Molecular Formula

  • C46-H80-O2

Molecular Weight

  • 665.136
 
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Names and Synonyms

Name of Substance

  • Amyrin palmitate

Synonym

  • alpha-Amyrin palmitate

Systematic Name

  • Olean-12-en-3-ol, hexadecanoate, (3beta)-

Registry Numbers

CAS Registry Number

  • 5973-06-8

System Generated Number

  • 0005973068

Structure Descriptors

InChI

1S/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-40(47)48-39-27-28-44(7)37(42(39,4)5)26-29-46(9)38(44)25-24-35-36-34-41(2,3)30-31-43(36,6)32-33-45(35,46)8/h24,36-39H,10-23,25-34H2,1-9H3/t36-,37?,38-,39+,43-,44+,45-,46-/m1/s1

InChIKey

VFSRKCNYYCXRGI-LAZBMHKSSA-N

Smiles

C1[C@@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)CC[C@@]5(C)CCC(C)(C)C[C@H]5C4=CC[C@H]3[C@@]2(C1)C)OC(CCCCCCCCCCCCCCC)=O