CP-78545

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H58O7
Molecular Weight	566.8094
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(CC[C@H](C)[C@@]([H])(O1)[C@@H](C)[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)CC\C=C\[C@@H](C)[C@@H](O)C(\C)=C\[C@H](C)CC=C)[C@H](C)C(O)=O

InChI

InChIKey=CHYQBJKLYBRPQK-KGFGMBRESA-N

InChI=1S/C33H58O7/c1-10-13-19(2)18-22(5)29(35)20(3)14-11-12-15-27(34)23(6)30(36)25(8)31(37)26(9)32-21(4)16-17-28(40-32)24(7)33(38)39/h10-11,14,18-21,23-32,34-37H,1,12-13,15-17H2,2-9H3,(H,38,39)/b14-11+,22-18+/t19-,20-,21+,23+,24+,25+,26+,27-,28+,29-,30+,31+,32-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C33H58O7
Molecular Weight	566.8094
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:55:50 GMT 2023` Edited by `admin` on `Sat Dec 16 09:55:50 GMT 2023`
Record UNII	6490GN9410
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CP-78545

Common Name

English

2H-PYRAN-2-ACETIC ACID, TETRAHYDRO-.ALPHA.,5-DIMETHYL-6-((1S,2S,3S,4S,5S,6R,9E,11R,12R,13E,15R)-2,4,6,12-TETRAHYDROXY-1,3,5,11,13,15-HEXAMETHYL-9,13,17-OCTADECATRIENYL)-, (.ALPHA.S,2S,5S,6R)-

Systematic Name

English

2H-PYRAN-2-ACETIC ACID, TETRAHYDRO-.ALPHA.,5-DIMETHYL-6-(2,4,6,12-TETRAHYDROXY-1,3,5,11,13,15-HEXAMETHYL-9,13,17-OCTADECATRIENYL)-, (2S-(2.ALPHA.(R*),5.ALPHA.,6.BETA.(1R*,2R*,3R*,4R*,5R*,6S*,9E,11S*,12S*,13E,15S*)))-

Systematic Name

English

Code System Code Type Description

PUBCHEM

119081396

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY

CAS

124150-86-3

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY

FDA UNII

6490GN9410

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY