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Chemical structure of 17-hydroxy Venturicidin A

GC41958

17-hydroxy Venturicidin A

Also known as [(2R,3R,4R,6R)-6-[[(1R,5R,6R,8S,9Z,11R,15Z,17R)-1,7-dihydroxy-5-[(2R,4R,5S,6S)-5-hydroxy-4,6-dimethyl-7-oxononan-2-yl]-6,8,16,18-tetramethyl-3-oxo-4,21-dioxabicyclo[15.3.1]henicosa-9,15,18-trien-11-yl]oxy]-3-hydroxy-2-methyloxan-4-yl] carbamate

17-hydroxy Venturicidin A is a macrolide fungal metabolite originally isolated from Streptomyces

ChemicalCAS113204-43-6MW766FormulaC41H67NO12
CAS number
113204-43-6
Molecular weight
766
Formula
C41H67NO12
Solubility
DMSO： Soluble,Ethanol： 1 mg/ml,Methanol： Soluble
InChIKey
BAMOPHNQZMRRFR-FZMBSIFWSA-N
Catalogue number
GC41958
Brand
GLPBIO
Computed properties PubChem CID 156588854 · XLogP 4.1 · TPSA 204 Ų · H-bond donors 5
XLogP
4.1
TPSA
204 Ų
H-bond donors
5
H-bond acceptors
12
Rotatable bonds
11
Heavy atoms
54

SMILES CCC(=O)[C@@H](C)[C@H]([C@H](C)C[C@@H](C)[C@@H]1[C@@H](C([C@H](/C=C\[C@@H](CCC/C=C(\[C@@H]2C(=CC[C@@](O2)(CC(=O)O1)O)C)/C)O[C@H]3C[C@H]([C@@H]([C@H](O3)C)O)OC(=O)N)C)O)C)O

Computed descriptors from PubChem (CID 156588854), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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