ARDACIN A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C81H82Cl4N8O30
Molecular Weight	1789.365
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]%13(OC1=CC(O)=CC2=C1C3=C(O)C=CC(=C3)[C@H]4NC(=O)[C@@H]5NC(=O)[C@H]6NC(=O)[C@H](NC(=O)[C@H](NC)C7=CC=C(O)C(OC8=CC(O)=C(Cl)C6=C8)=C7)[C@H](O)C9=CC=C(OC%10=C(O[C@@H]%11O[C@@H]([C@@H](O)[C@H](O)[C@H]%11NC(=O)CCCCCCCCC)C(O)=O)C(OC%12=C(Cl)C=C(C=C%12Cl)[C@@H](O)[C@H](NC4=O)C(=O)N[C@@H]2C(O)=O)=CC5=C%10)C(Cl)=C9)O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]%13O

InChI

InChIKey=SFGRLMCXHBJMSU-PKMCQBQCSA-N

InChI=1S/C81H82Cl4N8O30/c1-3-4-5-6-7-8-9-10-51(99)87-61-65(103)67(105)71(79(115)116)123-80(61)122-70-48-22-32-23-49(70)119-69-40(83)19-33(20-41(69)84)63(101)60-77(112)91-58(78(113)114)37-24-34(95)25-47(120-81-68(106)66(104)64(102)50(28-94)121-81)52(37)36-17-29(11-14-42(36)96)55(73(108)93-60)88-74(109)56(32)89-75(110)57-38-26-35(27-44(98)53(38)85)117-46-21-30(12-15-43(46)97)54(86-2)72(107)92-59(76(111)90-57)62(100)31-13-16-45(118-48)39(82)18-31/h11-27,50,54-68,71,80-81,86,94-98,100-106H,3-10,28H2,1-2H3,(H,87,99)(H,88,109)(H,89,110)(H,90,111)(H,91,112)(H,92,107)(H,93,108)(H,113,114)(H,115,116)/t50-,54-,55-,56-,57+,58+,59-,60+,61-,62-,63-,64-,65-,66+,67+,68+,71+,80-,81+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C81H82Cl4N8O30
Molecular Weight	1789.365
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 `Sat Dec 16 09:41:00 GMT 2023` Edited by `admin` on `Sat Dec 16 09:41:00 GMT 2023`
Record UNII	572P13F83X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ARDACIN A

Common Name

English

RISTOMYCIN A AGLYCONE, 5,22,31,55-TETRACHLORO-7-DEMETHYL-64-O-DEMETHYL-56-O-(2-DEOXY-2-((1-OXODECYL)AMINO)-.BETA.-D-GLUCOPYRANURONOSYL)-42-O-.ALPHA.-D-MANNOPYRANOSYL-N15-METHYL-

Systematic Name

English

ANTIBIOTIC AAD-216A

Common Name

English

AAD-216A

Code

English

ARIDICIN A

Common Name

English

SK&F-100814A

Code

English

Code System Code Type Description

CAS

95935-21-0

Created by admin on Sat Dec 16 09:41:00 GMT 2023 , Edited by admin on Sat Dec 16 09:41:00 GMT 2023

PRIMARY

FDA UNII

572P13F83X

Created by admin on Sat Dec 16 09:41:00 GMT 2023 , Edited by admin on Sat Dec 16 09:41:00 GMT 2023

PRIMARY

PUBCHEM

86278229

Created by admin on Sat Dec 16 09:41:00 GMT 2023 , Edited by admin on Sat Dec 16 09:41:00 GMT 2023

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Related Record Type Details


					572P13F83X

ARDACIN A

ACTIVE MOIETY