SULFOMYCIN II

Details

Stereochemistry	UNKNOWN
Molecular Formula	C54H52N16O15S2
Molecular Weight	1229.219
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(NC(=O)C2=CSC(=N2)C3=CC=C(N=C3C4=COC(=N4)C(=C)NC(=O)C(=C)NC(=O)C5=C(C)OC(=N5)\C(NC(=O)C6=CSC(=N6)C(NC(=O)C7=C(C)OC(=N7)\C(NC1=O)=C\CC)OC)=C\C)C(=O)NC(=C)C(=O)NC(=C)C(=O)NC(=C)C(N)=O)[C@H](C)O

InChI

InChIKey=YLAOQAUAEMFVRM-RCQRQMMJSA-N

InChI=1S/C54H52N16O15S2/c1-12-14-31-51-69-37(27(10)85-51)48(81)70-52(82-11)54-66-33(19-87-54)44(77)62-29(13-2)50-68-36(26(9)84-50)47(80)59-23(6)42(75)60-24(7)49-64-32(17-83-49)38-28(53-65-34(18-86-53)45(78)67-35(25(8)71)46(79)63-31)15-16-30(61-38)43(76)58-22(5)41(74)57-21(4)40(73)56-20(3)39(55)72/h13-19,25,35,52,71H,3-7,12H2,1-2,8-11H3,(H2,55,72)(H,56,73)(H,57,74)(H,58,76)(H,59,80)(H,60,75)(H,62,77)(H,63,79)(H,67,78)(H,70,81)/b29-13-,31-14-/t25-,35+,52?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C54H52N16O15S2
Molecular Weight	1229.219
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	4
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:54:20 GMT 2023` Edited by `admin` on `Sat Dec 16 09:54:20 GMT 2023`
Record UNII	0JEG4DRB51
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SULFOMYCIN II

Common Name

English

Code System Code Type Description

FDA UNII

0JEG4DRB51

Created by admin on Sat Dec 16 09:54:20 GMT 2023 , Edited by admin on Sat Dec 16 09:54:20 GMT 2023

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CAS

102489-42-9

Created by admin on Sat Dec 16 09:54:20 GMT 2023 , Edited by admin on Sat Dec 16 09:54:20 GMT 2023

PRIMARY

PUBCHEM

86278235

Created by admin on Sat Dec 16 09:54:20 GMT 2023 , Edited by admin on Sat Dec 16 09:54:20 GMT 2023

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Related Record Type Details


					0JEG4DRB51

SULFOMYCIN II

ACTIVE MOIETY