AVILAMYCIN D2

Details

Stereochemistry	MIXED
Molecular Formula	C59H86Cl2O32
Molecular Weight	1378.201
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]2OC(C)=O)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(OC)C(Cl)=C(O)C(Cl)=C%11C)[C@@H](C)O%10)[C@@H](C)O9)O[C@@H]8[C@@H](C)O7)[C@H]6O

InChI

InChIKey=NPPIQEPEXBZSSB-LJXFXXSGSA-N

InChI=1S/C59H86Cl2O32/c1-20-34(45(73-12)36(61)37(66)35(20)60)52(69)85-40-21(2)78-32(14-28(40)64)83-41-23(4)88-57(15-29(41)65)92-49-24(5)79-33(16-56(49,9)93-57)84-46-39(68)53(80-22(3)42(46)72-11)86-43-30(17-71-10)82-55(47(74-13)38(43)67)87-54-48(81-27(8)63)44-31(18-75-54)90-59(91-44)51-50(76-19-77-51)58(70,25(6)62)26(7)89-59/h21-26,28-33,38-44,46-51,53-55,62,64-68,70H,14-19H2,1-13H3/t21-,22-,23-,24-,25?,26-,28-,29-,30-,31+,32+,33+,38+,39-,40-,41-,42+,43-,44-,46-,47+,48-,49-,50-,51-,53+,54+,55+,56-,57?,58+,59-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C59H86Cl2O32
Molecular Weight	1378.201
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 20:31:57 GMT 2025` Edited by `admin` on `Mon Mar 31 20:31:57 GMT 2025`
Record UNII	7581HM99U0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AVILAMYCIN D2

Preferred Name

English

Code System Code Type Description

PUBCHEM

135391045

Created by admin on Mon Mar 31 20:31:57 GMT 2025 , Edited by admin on Mon Mar 31 20:31:57 GMT 2025

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FDA UNII

7581HM99U0

Created by admin on Mon Mar 31 20:31:57 GMT 2025 , Edited by admin on Mon Mar 31 20:31:57 GMT 2025

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