TROSPECTOMYCIN SULFATE ANHYDROUS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H30N2O7.H2O4S
Molecular Weight	472.508
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TROSPECTOMYCIN SULFATE ANHYDROUS

Structure Search

SMILES

OS(O)(=O)=O.[H][C@@]12O[C@H](CCCC)CC(=O)[C@]1(O)O[C@]3([H])[C@@H](NC)[C@@H](O)[C@@H](NC)[C@H](O)[C@@]3([H])O2

InChI

InChIKey=CEBCZKQVZZWYPV-UAINHTBVSA-N

InChI=1S/C17H30N2O7.H2O4S/c1-4-5-6-8-7-9(20)17(23)16(24-8)25-15-13(22)10(18-2)12(21)11(19-3)14(15)26-17;1-5(2,3)4/h8,10-16,18-19,21-23H,4-7H2,1-3H3;(H2,1,2,3,4)/t8-,10-,11+,12+,13+,14-,15-,16+,17+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C17H30N2O7
Molecular Weight	374.4293
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	H2O4S
Molecular Weight	98.078
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 `Sat Dec 16 01:15:15 UTC 2023` Edited by `admin` on `Sat Dec 16 01:15:15 UTC 2023`
Record UNII	4333136H26
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TROSPECTOMYCIN SULFATE ANHYDROUS

Common Name

English

4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, 2-BUTYLDECAHYDRO-4A,7,9-TRIHYDROXY-6,8-BIS(METHYLAMINO)-, (2R-(2.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.))-, SULFATE (1:1) (SALT)

Common Name

English

(2R,4AR,5AR,6S,7S,8R,9S,9AR,10AS)-2-BUTYLDECAHYDRO-4A,7,9-TRIHYDROXY-6,8-BIS(METHYLAMINO)-4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE SULFATE (1:1) (SALT)

Common Name

English

Code System Code Type Description

PUBCHEM

9934492

Created by admin on Sat Dec 16 01:15:16 UTC 2023 , Edited by admin on Sat Dec 16 01:15:16 UTC 2023

PRIMARY

FDA UNII

4333136H26