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CID 159487500

HCID 159487500
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
No structure available

Basic information

InChIKey
LRGPIEWFUGHSCC-VYUHFKIGSA-N
Molecular formula
C210H208Cl2FN27O54S5
Average molar mass
4,224 g/mol

Names & identifiers

Preferred name
CID 159487500
IUPAC
(4S,5S,6R)-9-[[4-[3-[(chloro-λ3-chloranylidene)amino]phenyl]-1,3-thiazol-2-yl]amino]-4-(dimethylamino)-3,5,10,11-tetrahydroxy-6-methyl-1,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;(4S,5S,6R)-4-(dimethylamino)-9-[(4-ethyl-1,3-thiazol-2-yl)amino]-3,5,10,11-tetrahydroxy-6-methyl-1,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;(4S,5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-9-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino]-6-methyl-1,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;(4S,5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-6-methyl-1,12-dioxo-9-[(4-phenyl-1,3-thiazol-2-yl)amino]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;(4S)-4-(dimethylamino)-3,10,11-trihydroxy-1,12-dioxo-9-[(4-phenyl-1,3-thiazol-2-yl)amino]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;(4-fluorophenyl) N-[(5R,6S,7S)-9-carbamoyl-7-(dimethylamino)-1,6,8,12-tetrahydroxy-5-methyl-10,11-dioxo-5,5a,6,6a,7,10a-hexahydrotetracen-2-yl]carbamate;(4-methoxyphenyl) N-[(5R,6S,7S)-9-carbamoyl-7-(dimethylamino)-1,6,8,12-tetrahydroxy-5-methyl-10,11-dioxo-5,5a,6,6a,7,10a-hexahydrotetracen-2-yl]carbamate

Database identifiers

PubChem CID
159487500

Properties

Computed structural propertiesFilling in

Topological polar surface area
1,480 Ų
Hydrogen bond donors
41
Hydrogen bond acceptors
78
Rotatable bonds
38
Heavy atoms
299
Formal charge
0
Complexity
8,630

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