CHLOROTHRICIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C50H63ClO16
Molecular Weight	955.479
Optical Activity	UNSPECIFIED
Defined Stereocenters	16 / 16
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(Cl)C(C)=C1C(=O)O[C@@H]2C[C@H](O[C@H]3[C@H](O)C[C@H](O[C@H]4CCC[C@@H]5[C@@H]4C=C[C@H]6CCCC\C=C\[C@@H]7C=C([C@H](C)C[C@]78OC(=O)C(OC(=O)[C@@]56C)=C8O)C(O)=O)O[C@@H]3C)O[C@H](C)[C@H]2O

InChI

InChIKey=WUXHQHDSSKBJFH-DELKKKATSA-N

InChI=1S/C50H63ClO16/c1-24-23-50-29(20-31(24)45(55)56)13-10-8-7-9-12-28-16-17-30-32(49(28,5)48(59)66-43(44(50)54)47(58)67-50)14-11-15-35(30)63-38-21-34(52)42(27(4)62-38)65-39-22-37(41(53)26(3)61-39)64-46(57)40-25(2)33(51)18-19-36(40)60-6/h10,13,16-20,24,26-30,32,34-35,37-39,41-42,52-54H,7-9,11-12,14-15,21-23H2,1-6H3,(H,55,56)/b13-10+/t24-,26-,27-,28-,29-,30+,32-,34-,35+,37-,38+,39+,41-,42-,49-,50+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C50H63ClO16
Molecular Weight	955.479
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	16 / 16
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Screening for new compounds with antiherpes activity.	1984-10	6517562

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:19:45 GMT 2025` Edited by `admin` on `Mon Mar 31 22:19:45 GMT 2025`
Record UNII	I4O4K2RAQR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHLOROTHRICIN

Common Name

English

CHLOROTHRICIN [MI]

Preferred Name

English

Code System Code Type Description

CAS

34707-92-1

Created by admin on Mon Mar 31 22:19:45 GMT 2025 , Edited by admin on Mon Mar 31 22:19:45 GMT 2025

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FDA UNII

I4O4K2RAQR

Created by admin on Mon Mar 31 22:19:45 GMT 2025 , Edited by admin on Mon Mar 31 22:19:45 GMT 2025

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PUBCHEM

54688680

Created by admin on Mon Mar 31 22:19:45 GMT 2025 , Edited by admin on Mon Mar 31 22:19:45 GMT 2025

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MERCK INDEX

m3442

Created by admin on Mon Mar 31 22:19:45 GMT 2025 , Edited by admin on Mon Mar 31 22:19:45 GMT 2025

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Merck Index