ISOTRICHODERMOL

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H22O3
Molecular Weight	250.3334
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOTRICHODERMOL

Structure Search

SMILES

CC1=C[C@H]2O[C@@H]3[C@H](O)C[C@@](C)([C@]34CO4)[C@@]2(C)CC1

InChI

InChIKey=ICJDGHMOMSQSLB-LACSLYJWSA-N

InChI=1S/C15H22O3/c1-9-4-5-13(2)11(6-9)18-12-10(16)7-14(13,3)15(12)8-17-15/h6,10-12,16H,4-5,7-8H2,1-3H3/t10-,11-,12-,13+,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H22O3
Molecular Weight	250.3334
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:50:47 GMT 2025` Edited by `admin` on `Mon Mar 31 21:50:47 GMT 2025`
Record UNII	46VQD5MCP0
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TRICHOTHEC-9-EN-3-OL, 12,13-EPOXY-, (3.ALPHA.)-

Preferred Name

English

ISOTRICHODERMOL

Common Name

English

Code System Code Type Description

CHEBI

157603

Created by admin on Mon Mar 31 21:50:47 GMT 2025 , Edited by admin on Mon Mar 31 21:50:47 GMT 2025

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FDA UNII

46VQD5MCP0

Created by admin on Mon Mar 31 21:50:47 GMT 2025 , Edited by admin on Mon Mar 31 21:50:47 GMT 2025

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PUBCHEM

21125670

Created by admin on Mon Mar 31 21:50:47 GMT 2025 , Edited by admin on Mon Mar 31 21:50:47 GMT 2025

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CAS

104155-10-4

Created by admin on Mon Mar 31 21:50:47 GMT 2025 , Edited by admin on Mon Mar 31 21:50:47 GMT 2025

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EPA CompTox

DTXSID30908828

Created by admin on Mon Mar 31 21:50:47 GMT 2025 , Edited by admin on Mon Mar 31 21:50:47 GMT 2025

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