(Q105162290)

English

(7R,9S)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

anthracycline polyketide

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mass

511.184231508 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₉NO₉

0 references

canonical SMILES

O=C1C=2C=CC=C(OC)C2C(=O)C=3C=C4C(=C(O)C13)CC(O)(C(=O)C)CC4OC5OC(C)C(O)C(N)C5

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isomeric SMILES

COc1cccc2c1C(=O)c1cc3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@H]3O[C@@H]1C[C@H](N)[C@H](O)[C@H](C)O1

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found in taxon

Micromonospora

1 reference

stated in

New anthracycline glycosides from Micromonospora. II. Isolation, characterization and biological properties.

Identifiers

InChI

InChI=1S/C27H29NO9/c1-11-23(30)17(28)8-20(36-11)37-19-10-27(34,12(2)29)9-16-14(19)7-15-22(26(16)33)24(31)13-5-4-6-18(35-3)21(13)25(15)32/h4-7,11,17,19-20,23,30,33-34H,8-10,28H2,1-3H3/t11-,17-,19+,20+,23+,27-/m0/s1

0 references

InChIKey

MELGDFBIPJROHZ-YQZXLWCASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MELGDFBIPJROHZ-YQZXLWCASA-N

(Q105162290)

(7R,9S)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

Statements

Identifiers

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