MILBEMYCIN A4 5-OXIME

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H45NO7
Molecular Weight	555.7022
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
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[C@H](C)[C@@H](CC)O5)O4)OC(=O)[C@H](C=C(C)C1=NO)[C@@]23O

InChI

InChIKey=YCAZFHUABUMOIM-JUBNYKKYSA-N

InChI=1S/C32H45NO7/c1-6-27-21(4)12-13-31(40-27)17-25-16-24(39-31)11-10-20(3)14-19(2)8-7-9-23-18-37-29-28(33-36)22(5)15-26(30(34)38-25)32(23,29)35/h7-10,15,19,21,24-27,29,35-36H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+,33-28-/t19-,21-,24+,25-,26-,27+,29+,31+,32+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H45NO7
Molecular Weight	555.7022
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:25:09 UTC 2023` Edited by `admin` on `Fri Dec 15 16:25:09 UTC 2023`
Record UNII	6ZWJ394628
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MILBEMYCIN A4 5-OXIME

Common Name

English

(6R,25R)-5-DEMETHOXY-28-DEOXY-6,28-EPOXY-25-ETHYL-5-(HYDROXYIMINO)MILBEMYCIN B

Common Name

English

MILBEMYCIN B, 5-DEMETHOXY-28-DEOXY-6,28-EPOXY-25-ETHYL-5-(HYDROXYIMINO)-, (6R,25R)-

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C276