Structure Database (LMSD)

Common Name
Ganoderol B
Systematic Name
Lanosta-7,9(11),24-trien-3β,26-diol
Synonyms
LM ID
LMPR0106050019
Formula
C30H48O2
Exact Mass
Calculate m/z
440.36543
Status
Active
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]
Lanostane triterpenoids [PR010605]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Ganoderma lucidum (#5315)
Agaricomycetes (#155619)
Ganoderol B: a potent α-glucosidase inhibitor isolated from the fruiting body of Ganoderma lucidum.,
Phytomedicine, 2011
Pubmed ID: 21596546

String Representations

InChiKey (Click to copy)
AOXXVRDKZLRGTJ-AZIDVCJLSA-N
InChi (Click to copy)
InChI=1S/C30H48O2/c1-20(19-31)9-8-10-21(2)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,11,14,21-22,25-26,31-32H,8,10,12-13,15-19H2,1-7H3/b20-9+/t21-,22-,25+,26+,28-,29-,30+/m1/s1
SMILES (Click to copy)
C(C/C=C(/CO)\C)[C@H]([C@]1([H])[C@]2(C)[C@@](C3=CC[C@]4([H])[C@@](CC[C@@H]([C@@]4(C)C)O)(C)C3=CC2)(C)CC1)C

Other Databases

CHEBI ID
142261
PubChem CID
13934286

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 4
Aromatic Rings
Rotatable Bonds 5
Van der Waals Molecular Volume 487.78
Topological Polar Surface Area 40.46
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 7.80
Molar Refractivity 135.20

Admin

Created at
15th Dec 2023
Updated at
15th Dec 2023