MOXIDECTIN, 8-HYDROXYMETHYL-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H53NO9
Molecular Weight	655.818
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of MOXIDECTIN, 8-HYDROXYMETHYL-

Structure Search

SMILES

CO\N=C1/C[C@]2(C[C@@H]3C[C@@H](C\C=C(CO)\C[C@@H](C)\C=C\C=C4/CO[C@@H]5[C@H](O)C(C)=C[C@@H](C(=O)O3)[C@]45O)O2)O[C@@H]([C@H]1C)C(\C)=C\C(C)C

InChI

InChIKey=LSCMVEMQQBZGND-XJGZPOSUSA-N

InChI=1S/C37H53NO9/c1-21(2)13-24(5)33-25(6)31(38-43-7)18-36(47-33)17-29-16-28(46-36)12-11-26(19-39)14-22(3)9-8-10-27-20-44-34-32(40)23(4)15-30(35(41)45-29)37(27,34)42/h8-11,13,15,21-22,25,28-30,32-34,39-40,42H,12,14,16-20H2,1-7H3/b9-8+,24-13+,26-11-,27-10+,38-31+/t22-,25-,28+,29-,30-,32+,33+,34+,36-,37+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C37H53NO9
Molecular Weight	655.818
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:42:03 GMT 2025` Edited by `admin` on `Wed Apr 02 00:42:03 GMT 2025`
Record UNII	CUE6NTY2Y4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MILBEMYCIN B, 5-O-DEMETHYL-28-DEOXY-25-(1,3-DIMETHYL-1-BUTENYL)-6,28-EPOXY-30-HYDROXY-23-(METHOXYIMINO)-, (6R,23E,25S(E))-

Preferred Name

English

MOXIDECTIN, 8-HYDROXYMETHYL-

Common Name

English

MOXIDECTIN METABOLITE M4 (HYDROXYLATION METABOLITE)

Common Name

English

Code System Code Type Description

CAS

152830-04-1

Created by admin on Wed Apr 02 00:42:03 GMT 2025 , Edited by admin on Wed Apr 02 00:42:03 GMT 2025

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PUBCHEM

137528209

Created by admin on Wed Apr 02 00:42:03 GMT 2025 , Edited by admin on Wed Apr 02 00:42:03 GMT 2025

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FDA UNII

CUE6NTY2Y4

Created by admin on Wed Apr 02 00:42:03 GMT 2025 , Edited by admin on Wed Apr 02 00:42:03 GMT 2025

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MOXIDECTIN

PARENT -> METABOLITE