Structure Database (LMSD)

Common Name
Maytenonic Acid
Systematic Name
3-oxo-D:A-friedooleanan-20α-29-oic acid
Synonyms
  • Polpunonic acid
  • 3-oxofriedelan-20alpha-29-oic acid
LM ID
LMPR0106150077
Formula
C30H48O3
Exact Mass
Calculate m/z
456.360346
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C30 isoprenoids (triterpenes) [PR0106]
Oleanane triterpenoids [PR010615]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Gymnosporia senegalensis (#256095)
Magnoliopsida (#3398)
Structure elucidation of maytenonic acid, a new triterpene from Maytenus senegalensis (celastraceae).,
J Pharm Sci, 1971
Pubmed ID: 5115253

String Representations

InChiKey (Click to copy)
WHWHDGKOSUKYOV-GDXNDQEESA-N
InChi (Click to copy)
InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,4)11-10-22-28(21,5)15-17-30(7)23-18-26(3,24(32)33)13-12-25(23,2)14-16-29(22,30)6/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21+,22-,23+,25+,26+,27+,28-,29+,30-/m0/s1
SMILES (Click to copy)
C1C(=O)[C@H](C)[C@@]2(C)CC[C@]3([H])[C@@]4(C)CC[C@@]5(C)CC[C@](C(=O)O)(C)C[C@@]5([H])[C@]4(C)CC[C@@]3(C)[C@]2([H])C1

Other Databases

CHEBI ID
66769
PubChem CID
169521

Calculated Physicochemical Properties

Heavy Atoms 33
Rings 5
Aromatic Rings
Rotatable Bonds 1
Van der Waals Molecular Volume 486.85
Topological Polar Surface Area 54.37
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP 7.52
Molar Refractivity 131.71

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Created at
11th Nov 2025
Updated at
11th Nov 2025