EPRINOMECTIN B1B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C49H73NO14
Molecular Weight	900.1022
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC\C3=C/C=C/[C@H](C)[C@H](O[C@@]4([H])C[C@H](OC)[C@@]([H])(O[C@@]5([H])C[C@H](OC)[C@H](NC(C)=O)[C@H](C)O5)[C@H](C)O4)\C(C)=C\C[C@]6([H])C[C@@]([H])(C[C@@]7(O[C@H](C(C)C)[C@@H](C)C=C7)O6)OC(=O)[C@]([H])(C=C(C)[C@H]1O)[C@@]23O

InChI

InChIKey=WPNHOHPRXXCPRA-FZTOWWROSA-N

InChI=1S/C49H73NO14/c1-25(2)43-28(5)17-18-48(64-43)23-35-20-34(63-48)16-15-27(4)44(26(3)13-12-14-33-24-57-46-42(52)29(6)19-36(47(53)60-35)49(33,46)54)61-40-22-38(56-11)45(31(8)59-40)62-39-21-37(55-10)41(30(7)58-39)50-32(9)51/h12-15,17-19,25-26,28,30-31,34-46,52,54H,16,20-24H2,1-11H3,(H,50,51)/b13-12+,27-15+,33-14+/t26-,28-,30-,31-,34+,35-,36-,37-,38-,39-,40-,41+,42+,43+,44-,45-,46+,48+,49+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C49H73NO14
Molecular Weight	900.1022
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	19 / 19
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:41:06 GMT 2023` Edited by `admin` on `Fri Dec 15 15:41:06 GMT 2023`
Record UNII	31OML2QZ0Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EPRINOMECTIN B1B

Common Name

English

EPRINOMECTIN COMPONENT B1B [MI]

Common Name

English

AVERMECTIN A1A, 4 SUP(2)-(ACETYLAMINO)-5-O-DEMETHYL-25-DE(1-METHYLPROPYL)-4 SUP(2)-DEOXY-25-(1-METHYLETHYL)-, (4 SUP(2)R)-

Common Name

English

EPRINOMECTIN COMPONENT B1B

Common Name

English

AVERMECTIN A1A, 4''-(ACETYLAMINO)-5-O-DEMETHYL-25-DE(1-METHYLPROPYL)-4''-DEOXY-25-(1-METHYLETHYL)-, (4''R)-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C250