InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1

【InChIKey】

InChIKey=SLJTWDNVZKIDAU-SVAFSPIFSA-N

【SMILES】

CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)C(=O)O

【MOL File】

BETULONIC ACID.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:1

H bond acceptor:3

XLogP3:7.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

BETULONIC ACID.cml

Quick Release

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4481-62-3 BETULONIC ACID

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】