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Chemical structure of Verrucarin A

GC48247

Verrucarin A

Also known as (1R,3R,8R,12S,13R,18E,20Z,24R,25S,26S)-12-hydroxy-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,18,20-triene-26,2'-oxirane]-11,17,22-trione

A macrocyclic trichothecene with diverse biological activities

ChemicalCAS3148-09-2MW502.6FormulaC27H34O9
CAS number
3148-09-2
Molecular weight
502.6
Formula
C27H34O9
Solubility
Dichloromethane： soluble,DMSO： soluble,Ethanol： soluble,Methanol： soluble
InChIKey
NLUGUZJQJYVUHS-IDXDZYHTSA-N
Catalogue number
GC48247
Brand
GLPBIO
Computed properties PubChem CID 6326658 · XLogP 2.4 · TPSA 121 Ų · H-bond donors 1
XLogP
2.4
TPSA
121 Ų
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
0
Heavy atoms
36

SMILES C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@@H]3[C@]4([C@]2([C@]5(CCC(=C[C@H]5O3)C)COC(=O)[C@H]1O)C)CO4

Computed descriptors from PubChem (CID 6326658), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Lead time
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Pricing
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Documents
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