CP-84657

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C45H78O14
Molecular Weight	843.0924
Optical Activity	UNSPECIFIED
Defined Stereocenters	22 / 22
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(C[C@H](C)[C@@]([H])(O1)[C@]2(C)C[C@@H](O[C@@]3([H])CC[C@H](OC)[C@@H](C)O3)[C@@]([H])(O2)[C@]4(C)CC[C@]5(O4)O[C@]([H])([C@@H](C)[C@@H](OC)[C@H](C)C(O)=O)[C@H](C)[C@@H](OC)[C@H]5C)[C@@]6(O)O[C@@](C)(C[C@@H]6C)[C@H](O)CC

InChI

InChIKey=GCWRBUNCTDXUMB-JYAWKEJFSA-N

InChI=1S/C45H78O14/c1-15-32(46)42(10)21-24(3)45(49,59-42)33-20-23(2)38(55-33)43(11)22-31(54-34-17-16-30(50-12)29(8)53-34)39(57-43)41(9)18-19-44(58-41)28(7)37(52-14)26(5)36(56-44)25(4)35(51-13)27(6)40(47)48/h23-39,46,49H,15-22H2,1-14H3,(H,47,48)/t23-,24-,25-,26-,27-,28+,29+,30-,31+,32+,33+,34-,35+,36+,37+,38+,39+,41-,42-,43-,44+,45-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C45H78O14
Molecular Weight	843.0924
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	22 / 22
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:58:21 GMT 2023` Edited by `admin` on `Sat Dec 16 08:58:21 GMT 2023`
Record UNII	7HN19N8JPO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CP-84657

Common Name

English

MONENSIN, 21,25-DEEPOXY-25-DE(HYDROXYMETHYL)-16-DEMETHYL-21,24-EPOXY-16,25-DIETHYL-21-HYDROXY-8-METHYL-7-O-METHYL-14-((TETRAHYDRO-5-METHOXY-6-METHYL-2H-PYRAN-2-YL)OXY)-, (8R,14R(2S,5S,6R),21S,24S,25R)-

Systematic Name

English

ANTIBIOTIC A-82810

Code

English

Code System Code Type Description

FDA UNII

7HN19N8JPO

Created by admin on Sat Dec 16 08:58:21 GMT 2023 , Edited by admin on Sat Dec 16 08:58:21 GMT 2023

PRIMARY

PUBCHEM

9919017

Created by admin on Sat Dec 16 08:58:21 GMT 2023 , Edited by admin on Sat Dec 16 08:58:21 GMT 2023

PRIMARY

CAS

127759-24-4

Created by admin on Sat Dec 16 08:58:21 GMT 2023 , Edited by admin on Sat Dec 16 08:58:21 GMT 2023

PRIMARY