ER-811475

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H60O13
Molecular Weight	748.8966
Optical Activity	UNSPECIFIED
Defined Stereocenters	18 / 18
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1[C@@H](C[C@H](O)CO)O[C@H]2C[C@H]3O[C@H](C[C@@H](C)C3=C)CC[C@@H]4O[C@H](CC4=C)CCC(=O)C[C@H]5O[C@@H]6[C@@H](O[C@H]7CC[C@H](CC(=O)C[C@H]12)O[C@@H]7[C@@H]6O)[C@H]5O

InChI

InChIKey=DRIHUUFRFITXNV-XXZFRVJGSA-N

InChI=1S/C40H60O13/c1-19-11-26-7-9-29-20(2)12-25(48-29)6-5-22(42)15-33-35(45)39-40(53-33)36(46)38-30(52-39)10-8-27(50-38)13-23(43)14-28-32(17-31(49-26)21(19)3)51-34(37(28)47-4)16-24(44)18-41/h19,24-41,44-46H,2-3,5-18H2,1,4H3/t19-,24+,25+,26+,27-,28+,29+,30+,31-,32+,33-,34-,35+,36+,37-,38+,39+,40+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

ER811475

Preferred Name

English

ER-811475

Code

English

(2R,3R,3aS,7R,10S,11R,12S,13S,14S,15S,16R,21S,24S,27S,29R,31R,32aS)-2-[(2S)-2,3-dihydroxypropyl]octacosahydro-12,15-dihydroxy-3-methoxy-29-methyl-23,30-bis(methylene)-7,11:10,14:13,16:21,24:27,31-Pentaepoxy-2H-cyclohentriaconta[b]furan-5,18(3H,4H)-dione

Systematic Name

English

7,11:10,14:13,16:21,24:27,31-Pentaepoxy-2H-cyclohentriaconta[b]furan-5,18(3H,4H)-dione, 2-[(2S)-2,3-dihydroxypropyl]octacosahydro-12,15-dihydroxy-3-methoxy-29-methyl-23,30-bis(methylene)-, (2R,3R,3aS,7R,10S,11R,12S,13S,14S,15S,16R,21S,24S,27S,29R,31R,32a

Systematic Name

English

Code System Code Type Description

CAS

728043-99-0

Created by admin on Wed Apr 02 17:56:56 GMT 2025 , Edited by admin on Wed Apr 02 17:56:56 GMT 2025

PRIMARY

FDA UNII

8426RBM6V9

Created by admin on Wed Apr 02 17:56:56 GMT 2025 , Edited by admin on Wed Apr 02 17:56:56 GMT 2025

PRIMARY

PUBCHEM

122546470

Created by admin on Wed Apr 02 17:56:56 GMT 2025 , Edited by admin on Wed Apr 02 17:56:56 GMT 2025

PRIMARY

SUBSTANCE RECORD


					8426RBM6V9

ER-811475