AVILAMYCIN E

Details

Stereochemistry	MIXED
Molecular Formula	C57H84Cl2O31
Molecular Weight	1336.164
Optical Activity	UNSPECIFIED
Defined Stereocenters	31 / 32
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC[C@H]1O[C@@H](O[C@@H]2OC[C@@H]3O[C@]4(O[C@H]3[C@H]2O)O[C@H](C)[C@@](O)([C@H](C)O)[C@@H]5OCO[C@@H]45)[C@@H](OC)[C@@H](O)[C@@H]1O[C@@H]6O[C@H](C)[C@H](OC)[C@H](O[C@H]7C[C@@]8(C)OC9(C[C@@H](O)[C@H](O[C@H]%10C[C@@H](O)[C@H](OC(=O)C%11=C(C)C(Cl)=C(O)C(Cl)=C%11OC)[C@@H](C)O%10)[C@@H](C)O9)O[C@@H]8[C@@H](C)O7)[C@H]6O

InChI

InChIKey=WLAAXYIHCWECSL-KNNYJUHFSA-N

InChI=1S/C57H84Cl2O31/c1-19-32(44(71-11)34(59)35(63)33(19)58)50(67)82-39-20(2)76-30(13-26(39)61)80-40-22(4)85-55(14-27(40)62)89-47-23(5)77-31(15-54(47,8)90-55)81-45-38(66)52(78-21(3)41(45)70-10)83-42-28(16-69-9)79-53(46(72-12)36(42)64)84-51-37(65)43-29(17-73-51)87-57(88-43)49-48(74-18-75-49)56(68,24(6)60)25(7)86-57/h20-31,36-43,45-49,51-53,60-66,68H,13-18H2,1-12H3/t20-,21-,22-,23-,24?,25-,26-,27-,28-,29+,30+,31+,36+,37-,38-,39-,40-,41+,42-,43-,45-,46+,47-,48-,49-,51+,52+,53+,54-,55?,56+,57-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C57H84Cl2O31
Molecular Weight	1336.164
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	31 / 32
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:31:59 GMT 2025` Edited by `admin` on `Mon Mar 31 20:31:59 GMT 2025`
Record UNII	239SHZ364Z
Record Status	`Validated (UNII)`
Record Version

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AVILAMYCIN E

Preferred Name

English

Code System Code Type Description

FDA UNII

239SHZ364Z

Created by admin on Mon Mar 31 20:31:59 GMT 2025 , Edited by admin on Mon Mar 31 20:31:59 GMT 2025

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PUBCHEM

135391067

Created by admin on Mon Mar 31 20:31:59 GMT 2025 , Edited by admin on Mon Mar 31 20:31:59 GMT 2025

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