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Chemical structure of Emestrin

GC46137

Emestrin

Also known as (1R,3R,9S,24S,25S,32R)-20,24,32-trihydroxy-16-methoxy-29-methyl-6,10,18-trioxa-26,27-dithia-2,29-diazaheptacyclo[23.2.2.11,4.12,25.119,23.03,9.012,17]dotriaconta-4,7,12(17),13,15,19,21,23(31)-octaene-11,28,30-trione

Emestrin (catalogue number GC46137) is a research-grade chemical available from LABO Scientific in Israel, CAS registry number 97816-62-1. Molecular formula C27H22N2O10S2, molecular weight 598.6. IUPAC name: (1R,3R,9S,24S,25S,32R)-20,24,32-trihydroxy-16-methoxy-29-methyl-6,10,18-trioxa-26,27-dithia-2,29-diazaheptacyclo[23.2.2.11,4.12,25.119,23.03,9.012,17]dotriaconta-4,7,12(17),13,15,19,21,23(31)-octaene-11,28,30-trione. Supplied in 2 pack sizes, from 1mg at ₪1,382.75 to 5mg at ₪4,486.81; the final price is confirmed on your quote, and the lot certificate of analysis and safety data sheet are emailed with your order confirmation.

ChemicalCAS97816-62-1MW598.6FormulaC27H22N2O10S2
CAS number
97816-62-1
Molecular weight
598.6
Formula
C27H22N2O10S2
Solubility
DMF： soluble,DMSO： soluble,Ethanol： soluble,Methanol： soluble
InChIKey
VASYTSFNISZKEL-DCTKBWBHSA-N
Catalogue number
GC46137
Brand
GLPBIO
Computed properties PubChem CID 73555 · XLogP -0.1 · TPSA 206 Ų · H-bond donors 3
XLogP
-0.1
TPSA
206 Ų
H-bond donors
3
H-bond acceptors
12
Rotatable bonds
1
Heavy atoms
41

SMILES CN1C(=O)[C@]23[C@@H](C4=COC=C[C@H]5[C@@H]4N2C(=O)[C@]1([C@H](C6=CC(=C(C=C6)O)OC7=C(C=CC=C7OC)C(=O)O5)O)SS3)O

Computed descriptors from PubChem (CID 73555), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
Quoted in ILS, excl. VAT. Add the item to your quote and we confirm the final price, usually the same business day.
Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
Who we serve
Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.