SEMAPIMOD TETRAHYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H52N18O2.4ClH
Molecular Weight	890.74
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure of SEMAPIMOD TETRAHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.Cl.Cl.C\C(=N/NC(N)=N)C1=CC(=CC(NC(=O)CCCCCCCCC(=O)NC2=CC(=CC(=C2)C(\C)=N\NC(N)=N)C(\C)=N\NC(N)=N)=C1)C(\C)=N\NC(N)=N

InChI

InChIKey=MAHASPGBAIQZLY-RTQZJKMDSA-N

InChI=1S/C34H52N18O2.4ClH/c1-19(45-49-31(35)36)23-13-24(20(2)46-50-32(37)38)16-27(15-23)43-29(53)11-9-7-5-6-8-10-12-30(54)44-28-17-25(21(3)47-51-33(39)40)14-26(18-28)22(4)48-52-34(41)42;;;;/h13-18H,5-12H2,1-4H3,(H,43,53)(H,44,54)(H4,35,36,49)(H4,37,38,50)(H4,39,40,51)(H4,41,42,52);4*1H/b45-19+,46-20+,47-21+,48-22+;;;;

HIDE SMILES / InChI

Molecular Formula	C34H52N18O2
Molecular Weight	744.8961
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	4
Optical Activity	NONE

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:11:52 UTC 2023` Edited by `admin` on `Fri Dec 15 18:11:52 UTC 2023`
Record UNII	A16WYQ522A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SEMAPIMOD TETRAHYDROCHLORIDE

Common Name

English

SEMAPIMOD HYDROCHLORIDE

Common Name

English

CNI-1493

Code

English

AXD-455

Code

English

DECANEDIAMIDE, N1,N10-BIS(3,5-BIS(1-(2-(AMINOIMINOMETHYL)HYDRAZINYLIDENE)ETHYL)PHENYL)-, HYDROCHLORIDE (1:4)

Common Name

English

Code System Code Type Description

SMS_ID

100000175159