8-HYDROXYCALONECTRIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H26O7
Molecular Weight	366.4055
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12O[C@]3([H])C=C(C)[C@@H](O)C[C@]3(COC(C)=O)[C@@](C)(C[C@H]1OC(C)=O)[C@]24CO4

InChI

InChIKey=OMBCNOXJYCTBAT-RBSDREOVSA-N

InChI=1S/C19H26O7/c1-10-5-15-18(6-13(10)22,8-23-11(2)20)17(4)7-14(25-12(3)21)16(26-15)19(17)9-24-19/h5,13-16,22H,6-9H2,1-4H3/t13-,14+,15+,16+,17+,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H26O7
Molecular Weight	366.4055
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:22:00 GMT 2023` Edited by `admin` on `Sat Dec 16 11:22:00 GMT 2023`
Record UNII	G68XES6P6Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

8-HYDROXYCALONECTRIN

Common Name

English

TRICHOTHEC-9-ENE-3,8,15-TRIOL, 12,13-EPOXY-, 3,15-DIACETATE, (3.ALPHA.,8.ALPHA.)-

Systematic Name

English

Code System Code Type Description

CAS

99494-92-5

Created by admin on Sat Dec 16 11:22:00 GMT 2023 , Edited by admin on Sat Dec 16 11:22:00 GMT 2023

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PUBCHEM

119026022

Created by admin on Sat Dec 16 11:22:00 GMT 2023 , Edited by admin on Sat Dec 16 11:22:00 GMT 2023

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FDA UNII

G68XES6P6Y

Created by admin on Sat Dec 16 11:22:00 GMT 2023 , Edited by admin on Sat Dec 16 11:22:00 GMT 2023

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EPA CompTox

DTXSID30912687

Created by admin on Sat Dec 16 11:22:00 GMT 2023 , Edited by admin on Sat Dec 16 11:22:00 GMT 2023

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