JOSAMYCIN 2A-PROPANOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C45H73NO16
Molecular Weight	884.0582
Optical Activity	UNSPECIFIED
Defined Stereocenters	16 / 16
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC(=O)O[C@H]1[C@H](O[C@H]2[C@@H](CC=O)C[C@@H](C)[C@@H](O)\C=C\C=C\C[C@@H](C)OC(=O)C[C@@H](OC(C)=O)[C@@H]2OC)O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC(C)C)[C@H](C)O3)[C@@H]1N(C)C

InChI

InChIKey=NBWASFCRCRXRKF-VGOAISAMSA-N

InChI=1S/C45H73NO16/c1-13-34(50)59-42-38(46(10)11)39(61-37-24-45(9,53)43(29(7)56-37)60-35(51)21-25(2)3)28(6)57-44(42)62-40-31(19-20-47)22-26(4)32(49)18-16-14-15-17-27(5)55-36(52)23-33(41(40)54-12)58-30(8)48/h14-16,18,20,25-29,31-33,37-44,49,53H,13,17,19,21-24H2,1-12H3/b15-14+,18-16+/t26-,27-,28-,29+,31+,32+,33-,37+,38+,39-,40+,41+,42-,43+,44+,45-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C45H73NO16
Molecular Weight	884.0582
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	16 / 16
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:39:59 GMT 2025` Edited by `admin` on `Mon Mar 31 22:39:59 GMT 2025`
Record UNII	911QFM8O20
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

JOSAMYCIN 2A-PROPANOATE

Preferred Name

English

Code System Code Type Description

CAS

31674-19-8

Created by admin on Mon Mar 31 22:39:59 GMT 2025 , Edited by admin on Mon Mar 31 22:39:59 GMT 2025

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FDA UNII

911QFM8O20

Created by admin on Mon Mar 31 22:39:59 GMT 2025 , Edited by admin on Mon Mar 31 22:39:59 GMT 2025

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PUBCHEM

10395904

Created by admin on Mon Mar 31 22:39:59 GMT 2025 , Edited by admin on Mon Mar 31 22:39:59 GMT 2025

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