ER-809681

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H56O11
Molecular Weight	712.866
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]%10(C[C@H]1O[C@@]2([H])C[C@@]3([H])O[C@]([H])(C[C@@H](C)C3=C)CC[C@]4([H])O[C@]([H])(CC4=C)CC[C@@]56C[C@@]7([H])O[C@]8([H])[C@@]([H])(O[C@@]9([H])CC[C@]([H])(CC(=O)C[C@]2([H])[C@H]1OC)O[C@]9([H])[C@]8([H])O5)[C@@]7([H])O6)CO%10

InChI

InChIKey=AIETXPLXNZJETJ-MWQPYSQBSA-N

InChI=1S/C40H56O11/c1-19-11-23-5-7-28-20(2)12-25(44-28)9-10-40-17-33-36(50-40)37-38(49-33)39(51-40)35-29(48-37)8-6-24(46-35)13-22(41)14-27-31(16-30(45-23)21(19)3)47-32(34(27)42-4)15-26-18-43-26/h19,23-39H,2-3,5-18H2,1,4H3/t19-,23+,24-,25+,26+,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39+,40+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H56O11
Molecular Weight	712.866
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	19 / 19
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:18:27 GMT 2023` Edited by `admin` on `Sat Dec 16 20:18:27 GMT 2023`
Record UNII	7Q66XY7ENC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ER-809681

Code

English

(2R,3R,3aS,7R,8aS,9S,10aR,11S,12R,13aR,13bS,15S,18S,21S,24S,26R,28R,29aS)-Hexacosahydro-3-methoxy-26-methyl-20,27-bis(methylene)-2-[(2S)-2-oxiranylmethyl]-11,15:18,21:24,28-triepoxy-7,9-ethano-12,15-methano-9H,15H-furo[3,2-i]furo[2′,3′:5,6]pyrano[4,3

Systematic Name

English

ER809681

Code

English

Code System Code Type Description

FDA UNII

7Q66XY7ENC

Created by admin on Sat Dec 16 20:18:27 GMT 2023 , Edited by admin on Sat Dec 16 20:18:27 GMT 2023

PRIMARY

CAS

1190395-92-6

Created by admin on Sat Dec 16 20:18:27 GMT 2023 , Edited by admin on Sat Dec 16 20:18:27 GMT 2023

PRIMARY