Structure Information
Structure

Compound Identification

SMILES

COC1=NN(CSP(=S)(OC)OC)C(=O)S1.CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@H](C[C@@H]2OC)O[C@H]2[C@@H](C)\C=C\C=C3/CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C2/C)O[C@@]2(C5)O[C@H](C(C)C)[C@@H](C)C=C2)[C@]34O)O[C@@H](C)[C@@H]1O.CC[C@H](C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C\C=C(C)\[C@@H](O[C@H]4C[C@H](OC)[C@@H](O[C@H]5C[C@H](OC)[C@@H](O)[C@H](C)O5)[C@H](C)O4)[C@@H](C)\C=C\C=C4/CO[C@@H]5[C@H](O)C(C)=C[C@@H](C(=O)O3)[C@]45O)O2)C=C[C@@H]1C

InChIKey

InChIKey=KDXBDLUDSFSTOR-RBLFQEOUSA-N

Formula

C101H153N2O32PS3

Mass

2034.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Macrolides and analogues

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Macrolides and analogues

Alternative Parents

1,3,4-thiadiazol-3-yl-organothiophosphates Disaccharides O-glycosyl compounds Alkyl aryl ethers Ketals Pyrans Oxanes Dithiophosphate O-esters Dithiophosphate S-esters Tertiary alcohols Oxolanes Heteroaromatic compounds Secondary alcohols Carboxylic acid esters Lactones Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organothiophosphorus compounds Dialkyl ethers Monocarboxylic acids and derivatives Organopnictogen compounds Organonitrogen compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives

Molecular Framework

Not available

Substituents

Macrolide - 1,3,4-thiadiazol-3-yl-organothiophosphate - O-glycosyl compound - Disaccharide - Glycosyl compound - Alkyl aryl ether - Ketal - Pyran - Oxane - Dithiophosphate s-ester - Dithiophosphate o-ester - Azole - Organic dithiophosphate - Oxolane - Thiadiazole - Heteroaromatic compound - Tertiary alcohol - Secondary alcohol - Carboxylic acid ester - Lactone - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organothiophosphorus compound - Sulfenyl compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alcohol - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as macrolides and analogues. These are organic compounds containing a lactone ring of at least twelve members.

External Descriptors

Not available

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