PROMOTHIOCIN B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H43N13O10S2
Molecular Weight	954.002
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@@H]1NC(=O)C2=CSC(=N2)C3=CC=C(N=C3C4=C(C)OC(=N4)[C@H](C)NC(=O)C5=CSC(=N5)[C@H](C)NC(=O)C6=C(C)OC(CNC1=O)=N6)C(=O)NC(=C)C(=O)NC(=C)C(=O)NC(=C)C(N)=O

InChI

InChIKey=GQPGNOKIVRVCQB-JVAKCPTJSA-N

InChI=1S/C42H43N13O10S2/c1-15(2)28-38(62)44-12-27-53-30(22(9)64-27)39(63)49-20(7)41-51-25(13-66-41)36(60)48-19(6)40-55-29(21(8)65-40)31-23(42-52-26(14-67-42)37(61)54-28)10-11-24(50-31)35(59)47-18(5)34(58)46-17(4)33(57)45-16(3)32(43)56/h10-11,13-15,19-20,28H,3-5,12H2,1-2,6-9H3,(H2,43,56)(H,44,62)(H,45,57)(H,46,58)(H,47,59)(H,48,60)(H,49,63)(H,54,61)/t19-,20-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H43N13O10S2
Molecular Weight	954.002
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:57:54 GMT 2025` Edited by `admin` on `Mon Mar 31 21:57:54 GMT 2025`
Record UNII	2I3243T16W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SF-2741B

Preferred Name

English

PROMOTHIOCIN B

Common Name

English

Code System Code Type Description

CAS

156737-06-3

Created by admin on Mon Mar 31 21:57:54 GMT 2025 , Edited by admin on Mon Mar 31 21:57:54 GMT 2025

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FDA UNII

2I3243T16W

Created by admin on Mon Mar 31 21:57:54 GMT 2025 , Edited by admin on Mon Mar 31 21:57:54 GMT 2025

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PUBCHEM

10920133

Created by admin on Mon Mar 31 21:57:54 GMT 2025 , Edited by admin on Mon Mar 31 21:57:54 GMT 2025

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