DESTRUXIN E

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H47N5O8
Molecular Weight	593.7122
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](C[C@H]3CO3)OC(=O)CCNC(=O)[C@H](C)N(C)C(=O)[C@H](C(C)C)N(C)C1=O

InChI

InChIKey=NIAYGGCQOYIHAF-OHOJESAGSA-N

InChI=1S/C29H47N5O8/c1-8-17(4)23-28(39)33(7)24(16(2)3)29(40)32(6)18(5)25(36)30-12-11-22(35)42-21(14-19-15-41-19)27(38)34-13-9-10-20(34)26(37)31-23/h16-21,23-24H,8-15H2,1-7H3,(H,30,36)(H,31,37)/t17-,18-,19-,20-,21+,23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H47N5O8
Molecular Weight	593.7122
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:13:08 GMT 2025` Edited by `admin` on `Mon Mar 31 22:13:08 GMT 2025`
Record UNII	Y168EWU66T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SB-242539

Preferred Name

English

DESTRUXIN E

Common Name

English

CYCLO(N-METHYL-L-ALANYL-.BETA.-ALANYL-4,5-ANHYDRO-3-DEOXY-D-ERYTHRO-PENTONOYL-L-PROLYL-L-ISOLEUCYL-N-METHYL-L-VALYL)

Systematic Name

English

DESTRUXIN E, (-)-

Common Name

English

DESTRUXIN DE

Common Name

English

Code System Code Type Description

PUBCHEM

46934590

Created by admin on Mon Mar 31 22:13:08 GMT 2025 , Edited by admin on Mon Mar 31 22:13:08 GMT 2025

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EPA CompTox

DTXSID70997998

Created by admin on Mon Mar 31 22:13:08 GMT 2025 , Edited by admin on Mon Mar 31 22:13:08 GMT 2025

PRIMARY

CAS

76689-14-0

Created by admin on Mon Mar 31 22:13:08 GMT 2025 , Edited by admin on Mon Mar 31 22:13:08 GMT 2025

PRIMARY

FDA UNII

Y168EWU66T

Created by admin on Mon Mar 31 22:13:08 GMT 2025 , Edited by admin on Mon Mar 31 22:13:08 GMT 2025

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