P-57AS3

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C47H74O15
Molecular Weight	879.0815
Optical Activity	UNSPECIFIED
Defined Stereocenters	21 / 21
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(C[C@H](OC)[C@H](O[C@@]2([H])C[C@H](OC)[C@H](O[C@]3([H])O[C@H](C)[C@@H](O)[C@H](OC)[C@H]3O)[C@@H](C)O2)[C@@H](C)O1)O[C@H]4CC[C@@]5(C)C(C4)=CC[C@]6([H])[C@]5([H])C[C@@H](OC(=O)C(\C)=C\C)[C@]7(C)[C@H](CC[C@]67O)C(C)=O

InChI

InChIKey=CBMQKMMZBOSHHP-VXXSQTRDSA-N

InChI=1S/C47H74O15/c1-12-23(2)43(51)60-35-20-32-31(47(52)18-16-30(24(3)48)46(35,47)8)14-13-28-19-29(15-17-45(28,32)7)59-36-21-33(53-9)40(26(5)56-36)61-37-22-34(54-10)41(27(6)57-37)62-44-39(50)42(55-11)38(49)25(4)58-44/h12-13,25-27,29-42,44,49-50,52H,14-22H2,1-11H3/b23-12+/t25-,26-,27-,29+,30-,31-,32+,33+,34+,35-,36+,37+,38-,39-,40-,41-,42+,44+,45+,46+,47+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C47H74O15
Molecular Weight	879.0815
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	21 / 21
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:05:13 GMT 2023` Edited by `admin` on `Sat Dec 16 11:05:13 GMT 2023`
Record UNII	870A6Q6XVJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

P-57AS3

Common Name

English

P57AS3

Code

English

P-57

Code

English

P57AS3 [MI]

Common Name

English

Code System Code Type Description

WIKIPEDIA

P57 (glycoside)