SALMYCIN A

Details

Stereochemistry	UNKNOWN
Molecular Formula	C41H70N7O21.Fe
Molecular Weight	1052.874
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 9
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Fe+3].[H][C@@]1(O[C@H](C=O)[C@H](O)[C@@H](O)[C@@H](O)C(CO)NC)O[C@@H](COC(=O)CCC(=O)N([O-])CCCCCNC(=O)CCC(=O)N([O-])CCCCCNC(=O)CCC(=O)N([O-])CCCCCO)[C@H](O)[C@@H](O)\C1=N/O

InChI

InChIKey=VBBPYQFDNOLRFZ-LXWYHESJSA-N

InChI=1S/C41H70N7O21.Fe/c1-42-26(23-50)36(58)40(62)37(59)27(24-51)68-41-35(45-63)39(61)38(60)28(69-41)25-67-34(57)16-15-33(56)48(66)20-8-3-6-18-44-29(52)11-13-31(54)46(64)19-7-2-5-17-43-30(53)12-14-32(55)47(65)21-9-4-10-22-49;/h24,26-28,36-42,49-50,58-63H,2-23,25H2,1H3,(H,43,53)(H,44,52);/q-3;+3/b45-35+;/t26?,27-,28+,36+,37+,38+,39+,40+,41-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C41H70N7O21
Molecular Weight	997.0288
Charge	-3
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	8 / 9
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	Fe
Molecular Weight	55.845
Charge	3
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:12:44 GMT 2023` Edited by `admin` on `Sat Dec 16 09:12:44 GMT 2023`
Record UNII	69MID602NR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SALMYCIN A

Common Name

English

Code System Code Type Description

FDA UNII

69MID602NR

Created by admin on Sat Dec 16 09:12:44 GMT 2023 , Edited by admin on Sat Dec 16 09:12:44 GMT 2023

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PUBCHEM

90479033

Created by admin on Sat Dec 16 09:12:44 GMT 2023 , Edited by admin on Sat Dec 16 09:12:44 GMT 2023

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CAS

163596-94-9

Created by admin on Sat Dec 16 09:12:44 GMT 2023 , Edited by admin on Sat Dec 16 09:12:44 GMT 2023

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