MITOMYCIN B

[(4S,6S,7R,8R)-7-hydroxy-11-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate

CAS: 4055-40-7

Molecular Formula	`C16H19N3O6`
Molecular Weight	349.34 g/mol
LogP	-0.3
Topological Polar Surface Area	122.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	4
Exact Mass	349.12738
Heavy Atoms	25
Complexity	787.0

Chemical Identifiers

CAS Number	4055-40-7
SMILES	`CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)O)N4C)OC`
InChIKey	`UZUUQCBCWDBYCG-DQRAMIIBSA-N`

📖 Product Overview

MITOMYCIN B (CAS: 4055-40-7) is a chemical compound with molecular formula C16H19N3O6 and molecular weight 349.34 g/mol. Its IUPAC systematic name is [(4S,6S,7R,8R)-7-hydroxy-11-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate. LogP -0.3 Topological Polar Surface Area 122.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 4 Exact Mass 349.12738 Heavy Atoms 25 Complexity 787.0 InChI Key: UZUUQCBCWDBYCG-DQRAMIIBSA-N. SMILES: CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)O)N4C)OC.

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