Hydroxychlorothricin

Hydroxychlorothricin

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Category Antibiotics
Catalog number BBF-00993
CAS
Molecular Weight 971.48
Molecular Formula C50H63ClO17

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Description

Hydroxychlorothricin is an antibiotic of the chlorothricin group produced by Streptomyces sp. K818. It has anti-tumor effect and can prolong the survival period of ICR mice inoculated with Ehrlich cancer cells.

Specification

IUPAC Name (1S,3R,6R,7Z,13R,16S,17S,21R,22R)-17-[(2R,3R,4R,5S,6R)-5-[(2S,4R,5R,6R)-4-(3-chloro-6-methoxy-2-methylbenzoyl)oxy-5-hydroxy-6-methyloxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-28-hydroxy-3,22-dimethyl-23,26-dioxo-24,27-dioxapentacyclo[23.2.1.01,6.013,22.016,21]octacosa-4,7,14,25(28)-tetraene-4-carboxylic acid
Canonical SMILES CC1CC23C(C=CCCCCC4C=CC5C(C4(C(=O)OC(=C2O)C(=O)O3)C)CCCC5OC6C(C(C(C(O6)C)OC7CC(C(C(O7)C)O)OC(=O)C8=C(C=CC(=C8C)Cl)OC)O)O)C=C1C(=O)O
InChI InChI=1S/C50H63ClO17/c1-23-22-50-28(20-30(23)44(56)57)13-10-8-7-9-12-27-16-17-29-31(49(27,5)48(60)67-42(43(50)55)46(59)68-50)14-11-15-33(29)65-47-40(54)39(53)41(26(4)63-47)66-36-21-35(38(52)25(3)62-36)64-45(58)37-24(2)32(51)18-19-34(37)61-6/h10,13,16-20,23,25-29,31,33,35-36,38-41,47,52-55H,7-9,11-12,14-15,21-22H2,1-6H3,(H,56,57)/b13-10-/t23-,25-,26-,27-,28-,29+,31-,33+,35-,36+,38-,39-,40-,41-,47+,49-,50+/m1/s1
InChI Key BOAFKDAAUUBJJK-XEQYPWMDSA-N

Properties

Appearance Colorless Powder
Antibiotic Activity Spectrum neoplastics (Tumor)
Melting Point 202°C

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L

* Our calculator is based on the following equation:
Concentration (start) x Volume (start) = Concentration (final) x Volume (final)
It is commonly abbreviated as: C1V1 = C2V2

* Total Molecular Weight:
g/mol
Tip: Chemical formula is case sensitive. C22H30N4O c22h30n40
g/mol
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