NANTRADOL HYDROCHLORIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C27H35NO4.ClH
Molecular Weight	474.032
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[H][C@@]12CC[C@@H](O)C[C@@]1([H])C3=C(N[C@H]2C)C=C(OC(C)CCCC4=CC=CC=C4)C=C3OC(C)=O

InChI

InChIKey=NSOGAHPJIFTUHV-DVTLTWPTSA-N

InChI=1S/C27H35NO4.ClH/c1-17(8-7-11-20-9-5-4-6-10-20)31-22-15-25-27(26(16-22)32-19(3)29)24-14-21(30)12-13-23(24)18(2)28-25;/h4-6,9-10,15-18,21,23-24,28,30H,7-8,11-14H2,1-3H3;1H/t17?,18-,21+,23-,24+;/m0./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	C27H35NO4
Molecular Weight	437.5711
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:23:56 GMT 2023` Edited by `admin` on `Fri Dec 15 15:23:56 GMT 2023`
Record UNII	CVN9D598JL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NANTRADOL HYDROCHLORIDE

Official Name

English

1,9-PHENANTHRIDINEDIOL, 5,6,6A,7,8,9,10,10A-OCTAHYDRO-6-METHYL-3-(1-METHYL-4-PHENYLBUTOXY)-, 1-ACETATE, HYDROCHLORIDE

Systematic Name

English

CP-44,001-1

Code

English

NANTRADOL HCL

Common Name

English

NANTRADOL HYDROCHLORIDE [USAN]

Common Name

English

(±)-5,6,6A.BETA.,7,8,9.ALPHA.,10,10A.ALPHA.-OCTAHYDRO-6.BETA.-METHYL-3-(1-METHYL-4-PHENYLBUTOXY)-1,9-PHENANTHRIDINEDIOL 1-ACETATE HYDROCHLORIDE

Systematic Name

English

CP-440011

Code

English

CP-44001-1

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C241