LIPID MAPS

Structure Database (LMSD)

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Common Name

Gambaoic acid B

Systematic Name

14-methyl-14,15-dihydroxyhexadecanoic acid

Synonyms

LM ID

LMFA01050617

Formula

C₁₇H₃₄O₄

Exact Mass

Calculate m/z

302.245711

Sum Composition

FA 17:0;O2

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

Reactions

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References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Bacillus sp. (in: firmicutes) (#1409)

Bacilli (#91061)

Four new hydroxyl fatty acids, gambaoic acids A-C and gambaoic B methyl ester, from Shrimp Jeotgal-derived Bacillus sp. SNB-066.,
J Antibiot (Tokyo), 2026

Pubmed ID: 41933253

DOI: 10.1038/s41429-026-00914-2

String Representations

InChiKey (Click to copy)

JUEMGHZPRUJPNP-UHFFFAOYSA-N

InChi (Click to copy)

InChI=1S/C17H34O4/c1-15(18)17(2,21)14-12-10-8-6-4-3-5-7-9-11-13-16(19)20/h15,18,21H,3-14H2,1-2H3,(H,19,20)

SMILES (Click to copy)

C(C)(O)C(O)(C)CCCCCCCCCCCCC(=O)O

Other Databases

PubChem CID

178328033

Calculated Physicochemical Properties

Heavy Atoms 21

Rings

Aromatic Rings

Rotatable Bonds 14

Van der Waals Molecular Volume 335.18

Topological Polar Surface Area 77.76

Hydrogen Bond Donors 3

Hydrogen Bond Acceptors 4

logP 4.46

Molar Refractivity 86.37

Admin

Created at

13th Apr 2026

Updated at