RHODOJAPONIN II

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H34O7
Molecular Weight	410.5012
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)O[C@@H]1C[C@]23C[C@@](C)(O)[C@H](CC[C@H]2[C@@](C)(O)[C@@H]4[C@@H]5O[C@@H]5C(C)(C)[C@@]14O)[C@H]3O

InChI

InChIKey=FJISLLRXVSQIES-JOIIKWRGSA-N

InChI=1S/C22H34O7/c1-10(23)28-13-8-21-9-19(4,25)11(16(21)24)6-7-12(21)20(5,26)15-14-17(29-14)18(2,3)22(13,15)27/h11-17,24-27H,6-9H2,1-5H3/t11-,12+,13-,14+,15+,16-,17+,19-,20-,21+,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H34O7
Molecular Weight	410.5012
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:01:34 GMT 2025` Edited by `admin` on `Tue Apr 01 18:01:34 GMT 2025`
Record UNII	X2F6R0716P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RHODOJAPONIN III 6-ACETATE

Preferred Name

English

RHODOJAPONIN II

Common Name

English

RHODOJAPONIN III, 9-ACETATE

Common Name

English

GRAYANOTOXANE-5,6,10,14,16-PENTOL, 2,3-EPOXY-, 6-ACETATE, (2.BETA.,3.BETA.,6.BETA.,14R)-

Systematic Name

English

Code System Code Type Description

CAS

26116-89-2

Created by admin on Tue Apr 01 18:01:34 GMT 2025 , Edited by admin on Tue Apr 01 18:01:34 GMT 2025

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FDA UNII

X2F6R0716P

Created by admin on Tue Apr 01 18:01:34 GMT 2025 , Edited by admin on Tue Apr 01 18:01:34 GMT 2025

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PUBCHEM

101306702

Created by admin on Tue Apr 01 18:01:34 GMT 2025 , Edited by admin on Tue Apr 01 18:01:34 GMT 2025

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EPA CompTox

DTXSID00949006

Created by admin on Tue Apr 01 18:01:34 GMT 2025 , Edited by admin on Tue Apr 01 18:01:34 GMT 2025

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