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Chemical structure of Brevetoxin 3

GC49740

Brevetoxin 3

Also known as (21Z)-12-hydroxy-14-[2-(hydroxymethyl)prop-2-enyl]-1,3,11,24,31,41,44-heptamethyl-2,6,10,15,19,25,29,34,38,43,47-undecaoxaundecacyclo[26.22.0.03,26.05,24.07,20.09,18.011,16.030,48.033,46.035,44.037,42]pentaconta-21,40-dien-39-one

Brevetoxin 3 (catalogue number GC49740) is a research-grade chemical available from LABO Scientific in Israel, CAS registry number 85079-48-7. Molecular formula C50H72O14, molecular weight 897.1. IUPAC name: (21Z)-12-hydroxy-14-[2-(hydroxymethyl)prop-2-enyl]-1,3,11,24,31,41,44-heptamethyl-2,6,10,15,19,25,29,34,38,43,47-undecaoxaundecacyclo[26.22.0.03,26.05,24.07,20.09,18.011,16.030,48.033,46.035,44.037,42]pentaconta-21,40-dien-39-one. Supplied as 100ug at ₪2,753.27; the final price is confirmed on your quote, and the lot certificate of analysis and safety data sheet are emailed with your order confirmation.

ChemicalCAS85079-48-7MW897.1FormulaC50H72O14
CAS number
85079-48-7
Molecular weight
897.1
Formula
C50H72O14
Solubility
DMSO： soluble,Ethanol： soluble,Methanol： soluble
InChIKey
BKMHDYJRAAJTAD-KTKRTIGZSA-N
Catalogue number
GC49740
Brand
GLPBIO
Computed properties PubChem CID 5353448 · XLogP 3.8 · TPSA 159 Ų · H-bond donors 2
XLogP
3.8
TPSA
159 Ų
H-bond donors
2
H-bond acceptors
14
Rotatable bonds
3
Heavy atoms
64

SMILES CC1CC2C(CC3(C(O2)CC4C(O3)C(=CC(=O)O4)C)C)OC5C1OC6CC7C(CC8C(O7)(C/C=C\C9C(O8)CC1C(O9)CC2C(O1)(C(CC(O2)CC(=C)CO)O)C)C)(OC6(CC5)C)C

Computed descriptors from PubChem (CID 5353448), 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.