23-KETO NEMADECTIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H50O8
Molecular Weight	610.7774
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC\C3=C/C=C/[C@H](C)C\C(C)=C\C[C@@H]4C[C@@H](C[C@]5(CC(=O)[C@H](C)[C@H](O5)C(\C)=C\C(C)C)O4)OC(=O)[C@H](C=C(C)[C@H]1O)[C@@]23O

InChI

InChIKey=VPWHZFYSDDOYRR-BVWZAJDSSA-N

InChI=1S/C36H50O8/c1-20(2)13-24(6)32-25(7)30(37)18-35(44-32)17-28-16-27(43-35)12-11-22(4)14-21(3)9-8-10-26-19-41-33-31(38)23(5)15-29(34(39)42-28)36(26,33)40/h8-11,13,15,20-21,25,27-29,31-33,38,40H,12,14,16-19H2,1-7H3/b9-8+,22-11+,24-13+,26-10+/t21-,25-,27+,28-,29-,31+,32+,33+,35-,36+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

23-KETO NEMADECTIN

Common Name

English

MOXIDECTIN METABOLITE V (OXIDATION METABOLITE)

Common Name

English

MILBEMYCIN B, 5-O-DEMETHYL-28-DEOXY-25-((1E)-1,3-DIMETHYL-1-BUTEN-1-YL)-6,28-EPOXY-23-OXO-, (6R,25S)-

Common Name

English

MILBEMYCIN B, 5-O-DEMETHYL-28-DEOXY-25-(1,3-DIMETHYL-1-BUTENYL)-6,28-EPOXY-23-OXO-, (6R,25S(E))-

Common Name

English

(6R,25S)-5-O-DEMETHYL-28-DEOXY-25-((1E)-1,3-DIMETHYL-1-BUTEN-1-YL)-6,28-EPOXY-23-OXOMILBEMYCIN B

Common Name

English

23-DESMETHOXYAMINO-23-OXO MOXIDECTIN

Common Name

English

Code System Code Type Description

FDA UNII

U8UGZ945KD

Created by admin on Sat Dec 16 14:44:36 GMT 2023 , Edited by admin on Sat Dec 16 14:44:36 GMT 2023

PRIMARY

PUBCHEM

14012057

Created by admin on Sat Dec 16 14:44:36 GMT 2023 , Edited by admin on Sat Dec 16 14:44:36 GMT 2023

PRIMARY

CAS

112124-81-9

Created by admin on Sat Dec 16 14:44:36 GMT 2023 , Edited by admin on Sat Dec 16 14:44:36 GMT 2023

PRIMARY

PARENT (METABOLITE)


					NGU5H31YO9

MOXIDECTIN

SUBSTANCE RECORD


					U8UGZ945KD

23-KETO NEMADECTIN