CINODINE II HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H59N13O13.3ClH
Molecular Weight	1003.326
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.Cl.Cl.C[C@H]1O[C@H](OC2=CC=C(\C=C\C(=O)NCCCNCCCCN)C=C2)[C@H](NC(N)=N)[C@@H](O)[C@@H]1NC(=O)N[C@H]3OC[C@@H](O[C@@H]4OC[C@H]5OC(=O)N[C@@H]5[C@H]4NC(N)=O)[C@H](O)[C@H]3NC(N)=O

InChI

InChIKey=QBDMTLDJLHPTCX-ZTSWYXKUSA-N

InChI=1S/C37H59N13O13.3ClH/c1-17-23(29(53)27(45-33(39)40)32(60-17)61-19-8-5-18(6-9-19)7-10-22(51)44-14-4-13-43-12-3-2-11-38)48-36(56)50-30-26(47-35(42)55)28(52)21(16-58-30)62-31-25(46-34(41)54)24-20(15-59-31)63-37(57)49-24;;;/h5-10,17,20-21,23-32,43,52-53H,2-4,11-16,38H2,1H3,(H,44,51)(H,49,57)(H4,39,40,45)(H3,41,46,54)(H3,42,47,55)(H2,48,50,56);3*1H/b10-7+;;;/t17-,20-,21-,23-,24+,25-,26-,27-,28+,29+,30+,31+,32-;;;/m1.../s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C37H59N13O13
Molecular Weight	893.9437
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:33:32 GMT 2025` Edited by `admin` on `Mon Mar 31 18:33:32 GMT 2025`
Record UNII	KGJ2ICY09M
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ANTIBIOTIC BM-123.GAMMA.2 HYDROCHLORIDE

Preferred Name

English

CINODINE II HYDROCHLORIDE

Common Name

English

CINODINE .GAMMA.(SUB 2)HYDROCHLORIDE

Common Name

English

Code System Code Type Description

PUBCHEM

72941591

Created by admin on Mon Mar 31 18:33:32 GMT 2025 , Edited by admin on Mon Mar 31 18:33:32 GMT 2025

PRIMARY

CAS

68681-93-6

Created by admin on Mon Mar 31 18:33:32 GMT 2025 , Edited by admin on Mon Mar 31 18:33:32 GMT 2025

PRIMARY

FDA UNII

KGJ2ICY09M

Created by admin on Mon Mar 31 18:33:32 GMT 2025 , Edited by admin on Mon Mar 31 18:33:32 GMT 2025

PRIMARY

NCI_THESAURUS

C90682

Created by admin on Mon Mar 31 18:33:32 GMT 2025 , Edited by admin on Mon Mar 31 18:33:32 GMT 2025

PRIMARY