LIPID MAPS

Structure Database (LMSD)

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Common Name

Viridominic acid A

Systematic Name

6α,16β-diacetoxy-11-oxo-3α,7β-dihydroxyfusida-17(20)Z,24-diene-21-oic acid

Synonyms

LM ID

LMPR0106040006

Formula

C₃₃H₄₈O₉

Exact Mass

Calculate m/z

588.329835

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

RYSOWAXDKQQGFZ-WDPSPDSKSA-N

InChi (Click to copy)

InChI=1S/C33H48O9/c1-16(2)10-9-11-20(30(39)40)25-21-14-23(37)28-31(6)13-12-22(36)17(3)26(31)27(42-19(5)35)29(38)33(28,8)32(21,7)15-24(25)41-18(4)34/h10,17,21-22,24,26-29,36,38H,9,11-15H2,1-8H3,(H,39,40)/b25-20-/t17-,21+,22-,24+,26-,27-,28+,29+,31+,32+,33-/m1/s1

SMILES (Click to copy)

C1C[C@]2(C)[C@]3([H])C(=O)C[C@@]4([H])/C(=C(\CC/C=C(\C)/C)/C(=O)O)/[C@@H](OC(C)=O)C[C@]4(C)[C@@]3(C)[C@@H](O)[C@H](OC(C)=O)[C@@]2([H])[C@H](C)[C@@H]1O

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Epidermophyton floccosum (#34391)

Eurotiomycetes (#147545)

Structures of viridominic acids A and B, new chlorosis-inducing metabolites of a fungus,
Tetrahedron Letts, 1972

DOI: 10.1016/S0040-4039(01)94162-0

Other Databases

PubChem CID

137331934

Calculated Physicochemical Properties

Heavy Atoms 42

Rings 4

Aromatic Rings

Rotatable Bonds 8

Van der Waals Molecular Volume 593.29

Topological Polar Surface Area 147.43

Hydrogen Bond Donors 3

Hydrogen Bond Acceptors 9

logP 5.53

Molar Refractivity 155.93

Admin

Created at

22nd Jul 2024

Updated at