PETASITENINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H27NO7
Molecular Weight	381.4202
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1O[C@]12C[C@@H](C)[C@@](C)(O)C(=O)OCC3=CCN(C)CC[C@@H](OC2=O)C3=O

InChI

InChIKey=CZQLULNMKQAIQL-PFDMWMSASA-N

InChI=1S/C19H27NO7/c1-11-9-19(12(2)27-19)17(23)26-14-6-8-20(4)7-5-13(15(14)21)10-25-16(22)18(11,3)24/h5,11-12,14,24H,6-10H2,1-4H3/b13-5-/t11-,12-,14-,18-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H27NO7
Molecular Weight	381.4202
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:35:55 GMT 2025` Edited by `admin` on `Mon Mar 31 21:35:55 GMT 2025`
Record UNII	737TK4X375
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PETASITENINE

Common Name

English

NSC-279000

Preferred Name

English

NSC-288753

Code

English

PETASITENINE (NEUTRAL)

Common Name

English

PETASITENINE [IARC]

Common Name

English

4,8-SECOSENECIONAN-8,11,16-TRIONE, 15,20-EPOXY-15,20-DIHYDRO-12-HYDROXY-4-METHYL-, (15.BETA.,20R)-

Systematic Name

English

SPIRO(2,9-DIOXA-14-AZABICYCLO(9.5.1)HEPTADEC-11-ENE-4,2'-OXIRANE)-3,8,17-TRIONE, 7-HYDROXY-3',6,7,14-TETRAMETHYL-, (1R-(1R*,4R*(R*),6R*,7R*))-

Systematic Name

English

FUKINOTOXIN

Common Name

English

SPIRO(2,9-DIOXA-14-AZABICYCLO(9.5.1)HEPTADEC-11-ENE-4,2'-OXIRANE)-3,8,17-TRIONE, 7-HYDROXY-3',6,7,14-TETRAMETHYL-, (1R,2'R,3'R,6R,7R)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID6021115