Subtilosin A
[CAS# 98914-01-3]

Identification

• Name: Subtilosin A
• Molecular Formula: C₁₂₉H₂₀₈N₃₆O₄₁S₃
• Molecular Weight: 3015.46
• CAS Registry Number: 98914-01-3
• SMILES: [C@@H](CC)(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC1=C[NH]C2=C1C=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N
• InChI: 1S/C129H208N36O41S3/c1-21-63(12)102(161-119(196)83(55-166)156-122(199)86(58-209)158-128(205)105(71(20)167)163-110(187)70(19)145-120(197)84(56-207)150-95(174)51-135-111(188)75(32-26-27-35-130)151-117(194)80(42-89(132)168)149-94(173)50-137-113(190)79(41-72-
• InChIKey: NRQODXJXWWUXFE-LYQFAKRDSA-N