SCARITOXIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C60H84O16
Molecular Weight	1061.2994
Optical Activity	UNSPECIFIED
Defined Stereocenters	31 / 31
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1[C@H](C)[C@]2(CCCO2)O[C@@H]3[C@@H]1O[C@H]4C[C@H]5O[C@H]6C[C@H]7O[C@H]8C\C=C\C[C@H]9O[C@H]%10C=C[C@H]%11O[C@@H]%12[C@@H](C[C@@H]%11O[C@@H]%10C=C[C@@H]9O[C@@H]8C[C@@H](O)[C@]7(C)O[C@@H]6C[C@H](C)C[C@@H]5O[C@@H]4[C@@H](C)[C@@H]3O)O[C@H]%13CC=C[C@@H](O[C@@H]%13[C@H]%12O)\C=C\C=C

InChI

InChIKey=QFYRPKKCVYDHFZ-FKFYNGSCSA-N

InChI=1S/C60H84O16/c1-7-8-13-34-14-11-17-41-56(65-34)53(63)57-49(69-41)26-43-40(72-57)21-20-38-39(67-43)19-18-37-35(66-38)15-9-10-16-36-45(68-37)28-50(61)59(6)51(71-36)29-46-47(75-59)25-30(2)24-42-44(70-46)27-48-54(73-42)32(4)52(62)58-55(74-48)31(3)33(5)60(76-58)22-12-23-64-60/h7-11,13-14,18-21,30-58,61-63H,1,12,15-17,22-29H2,2-6H3/b10-9+,13-8+/t30-,31+,32+,33+,34+,35-,36+,37+,38+,39-,40-,41+,42+,43+,44-,45-,46+,47-,48+,49-,50-,51-,52+,53-,54-,55-,56+,57-,58+,59+,60+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

SCARITOXIN

Common Name

English

52-EPI-CIGUATOXIN 4B

Preferred Name

English

CIGUATOXIN, 1,2-DIDEHYDRO-1,2,54-TRIDEOXY-, (52S)-

Systematic Name

English

TOXIN SG1

Common Name

English

CIGUATOXIN 4A

Common Name

English

CTX 4A

Common Name

English

Code System Code Type Description

FDA UNII

P251446IXQ

Created by admin on Tue Apr 01 17:47:04 GMT 2025 , Edited by admin on Tue Apr 01 17:47:04 GMT 2025

PRIMARY

EPA CompTox

DTXSID40880106

Created by admin on Tue Apr 01 17:47:04 GMT 2025 , Edited by admin on Tue Apr 01 17:47:04 GMT 2025

PRIMARY

CAS

66231-73-0

Created by admin on Tue Apr 01 17:47:04 GMT 2025 , Edited by admin on Tue Apr 01 17:47:04 GMT 2025

PRIMARY

PUBCHEM

6437372

Created by admin on Tue Apr 01 17:47:04 GMT 2025 , Edited by admin on Tue Apr 01 17:47:04 GMT 2025

PRIMARY

SUBSTANCE RECORD


					P251446IXQ

SCARITOXIN