5-O,12-didemethyl-25-de(1-methylpropyl)-12-ethyl-25-(1-methylethyl)-22,23-dihydroavermectin A1a

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C48H74O14
Molecular Weight	875.0928
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-O,12-didemethyl-25-de(1-methylpropyl)-12-ethyl-25-(1-methylethyl)-22,23-dihydroavermectin A<SUB>1a</SUB>

Structure Search

SMILES

CC[C@H]1\C=C\C=C2/CO[C@@H]3[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]4C[C@@H](C\C=C(C)\[C@H]1O[C@H]5C[C@H](OC)[C@@H](O[C@H]6C[C@H](OC)[C@@H](O)[C@H](C)O6)[C@H](C)O5)O[C@@]7(CC[C@H](C)[C@H](O7)C(C)C)C4)[C@]23O

InChI

InChIKey=NRFBPULVMHOZAJ-TWABEUOPSA-N

InChI=1S/C48H74O14/c1-11-31-13-12-14-32-24-55-45-40(49)28(6)19-35(48(32,45)52)46(51)58-34-20-33(61-47(23-34)18-17-27(5)42(62-47)25(2)3)16-15-26(4)43(31)59-39-22-37(54-10)44(30(8)57-39)60-38-21-36(53-9)41(50)29(7)56-38/h12-15,19,25,27,29-31,33-45,49-50,52H,11,16-18,20-24H2,1-10H3/b13-12+,26-15+,32-14+/t27-,29-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42+,43+,44-,45+,47+,48+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

5-O,12-didemethyl-25-de(1-methylpropyl)-12-ethyl-25-(1-methylethyl)-22,23-dihydroavermectin A1a

Systematic Name

English

12-demethyl-12-ethyl-H2B1b

Preferred Name

English

IVERMECTIN IMPURITY F [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

LN332GC3U5

Created by admin on Wed Apr 02 13:24:01 GMT 2025 , Edited by admin on Wed Apr 02 13:24:01 GMT 2025

PRIMARY

SUBSTANCE RECORD


					LN332GC3U5

5-O,12-didemethyl-25-de(1-methylpropyl)-12-ethyl-25-(1-methylethyl)-22,23-dihydroavermectin A1a