SPIRAMYCIN III ADIPATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C46H78N2O15.C6H10O4
Molecular Weight	1045.2571
Optical Activity	UNSPECIFIED
Defined Stereocenters	19 / 19
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CCCCC(O)=O.[H][C@@]1(CC[C@@H]([C@H](C)O1)N(C)C)O[C@H]2\C=C\C=C\C[C@@H](C)OC(=O)C[C@@H](OC(=O)CC)[C@H](OC)[C@@H](O[C@]3([H])O[C@H](C)[C@@H](O[C@@]4([H])C[C@@](C)(O)[C@@H](O)[C@H](C)O4)[C@@H]([C@H]3O)N(C)C)[C@@H](CC=O)C[C@H]2C

InChI

InChIKey=GAMOFVGOAOXHJV-QIDKPHOGSA-N

InChI=1S/C46H78N2O15.C6H10O4/c1-13-35(50)60-34-24-36(51)56-27(3)17-15-14-16-18-33(61-37-20-19-32(47(8)9)28(4)57-37)26(2)23-31(21-22-49)42(43(34)55-12)63-45-40(52)39(48(10)11)41(29(5)59-45)62-38-25-46(7,54)44(53)30(6)58-38;7-5(8)3-1-2-4-6(9)10/h14-16,18,22,26-34,37-45,52-54H,13,17,19-21,23-25H2,1-12H3;1-4H2,(H,7,8)(H,9,10)/b15-14+,18-16+;/t26-,27-,28+,29-,30+,31+,32+,33+,34-,37+,38+,39-,40-,41-,42+,43+,44+,45+,46-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C46H78N2O15
Molecular Weight	899.1159
Charge	0
Count

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

Molecular Formula	C6H10O4
Molecular Weight	146.1412
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 21:20:42 GMT 2023` Edited by `admin` on `Fri Dec 15 21:20:42 GMT 2023`
Record UNII	UL161N7V4G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SPIRAMYCIN III ADIPATE

Common Name

English

FOROMACIDIN C ADIPATE

Common Name

English

Code System Code Type Description

FDA UNII

UL161N7V4G

Created by admin on Fri Dec 15 21:20:42 GMT 2023 , Edited by admin on Fri Dec 15 21:20:42 GMT 2023

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SMS_ID

100000183691

Created by admin on Fri Dec 15 21:20:42 GMT 2023 , Edited by admin on Fri Dec 15 21:20:42 GMT 2023

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PUBCHEM

76971840

Created by admin on Fri Dec 15 21:20:42 GMT 2023 , Edited by admin on Fri Dec 15 21:20:42 GMT 2023

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