Betulin

Betulin, a triterpene with lupane nucleus, is found in the bark of birch trees. It undergoes rearrangement in the presence of acid agents to form allobetulin.

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Catalog Number CBB1112327
Alternative Name(s) Betulol; Lup-20(29)-ene-3β,28-diol; Trochol; Betulinol; Betulinic alcohol
Molecular Formula C30H50O2
CAS# 473-98-3
Purity >98%
Inchi 1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1
Inchi Key FVWJYYTZTCVBKE-ROUWMTJPSA-N
SMILES [H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@@]5(CO)CC[C@@H](C(C)=C)[C@]25[H]
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