ABAMECTIN B1A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C48H72O14
Molecular Weight	873.0769
Optical Activity	UNSPECIFIED
Defined Stereocenters	20 / 20
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@](C)(CC)[C@@]1([H])O[C@@]2(C[C@@H]3C[C@@]([H])(C\C=C(C)\[C@@H](O[C@@]4([H])C[C@H](OC)[C@@]([H])(O[C@@]5([H])C[C@H](OC)[C@@H](O)[C@H](C)O5)[C@H](C)O4)[C@@H](C)\C=C\C=C6/CO[C@]7([H])[C@H](O)C(C)=C[C@@]([H])(C(=O)O3)[C@]67O)O2)C=C[C@@H]1C

InChI

InChIKey=RRZXIRBKKLTSOM-XPNPUAGNSA-N

InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C48H72O14
Molecular Weight	873.0769
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	20 / 20
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:12:34 UTC 2023` Edited by `admin` on `Fri Dec 15 17:12:34 UTC 2023`
Record UNII	K54ZMM929K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ABAMECTIN B1A

Common Name

English

ABAMECTIN COMPONENT B1A

Common Name

English

5-O-DEMETHYLAVERMECTIN A1A

Common Name

English

IVERMECTIN IMPURITY A [EP IMPURITY]

Common Name

English

AVERMECTIN B1A

Common Name

English

AVERMECTIN A1A, 5-O-DEMETHYL-

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

265-610-3