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Chemical structure of Berninamycin D

GC40064

Berninamycin D

Also known as (14S,17Z,27S)-17-ethylidene-14-[(1R)-1-hydroxyethyl]-27-(2-hydroxypropan-2-yl)-20,33-dimethyl-24,30,37,40-tetramethylidene-12,15,22,25,28,35,38-heptaoxo-19,32,42-trioxa-9-thia-3,13,16,23,26,29,36,39,44,45,46,47-dodecazahexacyclo[39.2.1.18,11.118,21.131,34.02,7]heptatetraconta-1(43),2(7),3,5,8(47),10,18(46),20,31(45),33,41(44)-undecaene-4-carboxamide

Berninamycin D is a cyclic thiopeptide fungal metabolite originally isolated from S

ChemicalCAS161263-50-9MW1008FormulaC45H45N13O13S
CAS number
161263-50-9
Molecular weight
1008
Formula
C45H45N13O13S
Solubility
DMF： soluble,DMSO： soluble
InChIKey
ACYFBJUVNSGWDG-QGQKNWORSA-N
Catalogue number
GC40064
Brand
GLPBIO
Computed properties PubChem CID 10418522 · XLogP 1.6 · TPSA 419 Ų · H-bond donors 10
XLogP
1.6
TPSA
419 Ų
H-bond donors
10
H-bond acceptors
19
Rotatable bonds
3
Heavy atoms
72

SMILES C/C=C\1/C2=NC(=C(O2)C)C(=O)NC(=C)C(=O)N[C@H](C(=O)NC(=C)C3=NC(=C(O3)C)C(=O)NC(=C)C(=O)NC(=C)C4=NC(=CO4)C5=C(C=CC(=N5)C(=O)N)C6=NC(=CS6)C(=O)N[C@H](C(=O)N1)[C@@H](C)O)C(C)(C)O

Computed descriptors from PubChem (CID 10418522), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.