(Q77310197)

English

duocarmycin A (unspecified stereochemistry)

Bioactive natural product

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Statements

instance of

type of chemical entity

0 references

subclass of

indole alkaloid

0 references

mass

507.16416476 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₂₅N₃O₈

0 references

canonical SMILES

O=C1C=C2N(C(=O)C3=CC=4C=C(OC)C(OC)=C(OC)C4N3)CC5CC25C=6C(=O)C(NC16)(C(=O)OC)C

0 references

found in taxon

Streptomyces albidoflavus

1 reference

stated in

Duocarmycin A, a new antitumor antibiotic from Streptomyces.

different from

duocarmycin A

0 references

Identifiers

InChI

InChI=1S/C26H25N3O8/c1-25(24(33)37-5)22(31)17-19(28-25)14(30)8-16-26(17)9-12(26)10-29(16)23(32)13-6-11-7-15(34-2)20(35-3)21(36-4)18(11)27-13/h6-8,12,27-28H,9-10H2,1-5H3

0 references

InChIKey

AZVARJHZBXHUSO-UHFFFAOYSA-N

2 references

language of work or name

English

stated in

Natural Product Atlas

PubChem CID

107931

language of work or name

2 references

language of work or name

English

matched by identifier from

InChIKey

AZVARJHZBXHUSO-UHFFFAOYSA-N

ChEBI ID

201348

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C26H25N3O8/c1-25(24(33)37-5)22(31)17-19(28-25)14(30)8-16-26(17)9-12(26)10-29(16)23(32)13-6-11-7-15(34-2)20(35-3)21(36-4)18(11)27-13/h6-8,12,27-28H,9-10H2,1-5H3

1 reference

Natural Product Atlas ID

NPA004399

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

AZVARJHZBXHUSO-UHFFFAOYSA-N

(Q77310197)

duocarmycin A (unspecified stereochemistry)

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