MONOCROTALINE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H23NO6.ClH
Molecular Weight	361.818
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of MONOCROTALINE HYDROCHLORIDE

Structure Search

SMILES

Cl.[H][C@@]12[C@H]3CCN1CC=C2COC(=O)[C@](C)(O)[C@](C)(O)[C@@H](C)C(=O)O3

InChI

InChIKey=DYMOTPRLTOPMKK-HIKKEBQLSA-N

InChI=1S/C16H23NO6.ClH/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20;/h4,9,11-12,20-21H,5-8H2,1-3H3;1H/t9-,11+,12+,15+,16-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C16H23NO6
Molecular Weight	325.3569
Charge	0
Count

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

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 20:14:18 UTC 2023` Edited by `admin` on `Fri Dec 15 20:14:18 UTC 2023`
Record UNII	841INQ78E1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MONOCROTALINE HYDROCHLORIDE

Common Name

English

MONOCROTALINE, HYDROCHLORIDE

Common Name

English

20-NORCROTALANAN-11,15-DIONE, 14,19-DIHYDRO-12,13-DIHYDROXY-, HYDROCHLORIDE, (13.ALPHA.,14.ALPHA.)-

Common Name

English

MONOCROTALINE HYDROC [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

120833

Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023

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CAS

901-82-6

Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023

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EPA CompTox

DTXSID501009159

Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023

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FDA UNII

841INQ78E1

Created by admin on Fri Dec 15 20:14:18 UTC 2023 , Edited by admin on Fri Dec 15 20:14:18 UTC 2023

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