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Chemical structure of Retrorsine

GC63171

Retrorsine

Also known as (1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione

Retrorsine is a naturally occurring toxic pyrrolizidine alkaloid

ChemicalCAS480-54-6MW351.39FormulaC18H25NO6
CAS number
480-54-6
Molecular weight
351.39
Formula
C18H25NO6
Solubility
DMSO ： 100 mg/mL (284·58 mM; Need ultrasonic)
InChIKey
BCJMNZRQJAVDLD-CQRYIUNCSA-N
Catalogue number
GC63171
Brand
GLPBIO
Computed properties PubChem CID 5281743 · XLogP 0.6 · TPSA 96.3 Ų · H-bond donors 2
XLogP
0.6
TPSA
96.3 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
1
Heavy atoms
25

SMILES C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O)C

Computed descriptors from PubChem (CID 5281743), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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