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Substance Name: Urs-12-en-3-ol, tetratriacontanoate, (3beta)-
RN: 124693-68-1
InChIKey: JQGZKTFAYYVRDZ-ZZISAQBCSA-N

Molecular Formula

  • C64-H116-O2

Molecular Weight

  • 917.618
 
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Names and Synonyms

Synonym

  • alpha-Amyrin tetratriacontanoate

Systematic Name

  • Urs-12-en-3-ol, tetratriacontanoate, (3beta)-

Registry Numbers

CAS Registry Number

  • 124693-68-1

System Generated Number

  • 0124693681

Structure Descriptors

InChI

1S/C64H116O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-58(65)66-57-46-48-62(7)55(60(57,4)5)45-49-64(9)56(62)43-42-54-59-53(3)52(2)44-47-61(59,6)50-51-63(54,64)8/h42,52-53,55-57,59H,10-41,43-51H2,1-9H3/t52-,53+,55?,56-,57+,59-,61-,62+,63-,64-/m1/s1

InChIKey

JQGZKTFAYYVRDZ-ZZISAQBCSA-N

Smiles

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