ANTIMYCIN A4B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H34N2O9
Molecular Weight	506.5455
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC[C@@H]1[C@@H](OC(=O)CCC)[C@H](C)OC(=O)[C@@H](NC(=O)C2=C(O)C(NC=O)=CC=C2)[C@@H](C)OC1=O

InChI

InChIKey=GYANSQKXOLFAFP-IRSNHEQCSA-N

InChI=1S/C25H34N2O9/c1-5-7-10-17-22(36-19(29)9-6-2)15(4)35-25(33)20(14(3)34-24(17)32)27-23(31)16-11-8-12-18(21(16)30)26-13-28/h8,11-15,17,20,22,30H,5-7,9-10H2,1-4H3,(H,26,28)(H,27,31)/t14-,15+,17-,20+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H34N2O9
Molecular Weight	506.5455
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:10:37 GMT 2023` Edited by `admin` on `Sat Dec 16 08:10:37 GMT 2023`
Record UNII	WD7Q41KD4C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANTIMYCIN A4B

Common Name

English

BUTANOIC ACID, 8-BUTYL-3-((3-(FORMYLAMINO)-2-HYDROXYBENZOYL)AMINO)-2,6-DIMETHYL-4,9-DIOXO-1,5-DIOXONAN-7-YL ESTER, (2R,3S,6S,7R,8R)-

Systematic Name

English

BUTANOIC ACID, 8-BUTYL-3-((3-(FORMYLAMINO)-2-HYDROXYBENZOYL)AMINO)-2,6-DIMETHYL-4,9-DIOXO-1,5-DIOXONAN-7-YL ESTER, (2R-(2R*,3S*,6S*,7R*,8R*))-

Systematic Name

English

Code System Code Type Description

CAS

117603-45-9

Created by admin on Sat Dec 16 08:10:37 GMT 2023 , Edited by admin on Sat Dec 16 08:10:37 GMT 2023

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PUBCHEM

11755913

Created by admin on Sat Dec 16 08:10:38 GMT 2023 , Edited by admin on Sat Dec 16 08:10:38 GMT 2023

PRIMARY

EPA CompTox

DTXSID10151835

Created by admin on Sat Dec 16 08:10:37 GMT 2023 , Edited by admin on Sat Dec 16 08:10:37 GMT 2023

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FDA UNII

WD7Q41KD4C

Created by admin on Sat Dec 16 08:10:37 GMT 2023 , Edited by admin on Sat Dec 16 08:10:37 GMT 2023

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Related Record Type Details


					WD7Q41KD4C

ANTIMYCIN A4B

ACTIVE MOIETY